diff --git a/README b/README
new file mode 100644
index 0000000000000000000000000000000000000000..fc4fe6f6b8aefba35691d0f9cd85cc55101bffc3
--- /dev/null
+++ b/README
@@ -0,0 +1 @@
+The ./src directory needs to be placed in a plain accessible folder on the webserver. According paths and URIs then have to be modified in Python and Javascript files within in the beaker notebook
diff --git a/notebooks/band.bkr b/notebooks/band.bkr
index fd758f379d51a90a6fae26671aaec2dd123a2418..f96c77c8d00f758835616f2b5222481032f642bb 100644
--- a/notebooks/band.bkr
+++ b/notebooks/band.bkr
@@ -34,12 +34,158 @@
     ],
     "cells": [
         {
-            "id": "codeuKyTdi",
+            "id": "coderSQwp4",
+            "type": "code",
+            "evaluator": "Python3",
+            "input": {
+                "body": [
+                    "# Program to get all crystal structure images from json files using the ASE atoms object",
+                    "",
+                    "import json,glob",
+                    "from ase.lattice.cubic import BodyCenteredCubic",
+                    "from ase.io import write",
+                    "import numpy as np",
+                    "from ase import Atoms",
+                    "import os",
+                    "from IPython.display import Image",
+                    "",
+                    "",
+                    "",
+                    "",
+                    "conversion_ang_met = 1e10",
+                    "def getCrystalImage(files = glob.glob(\"/home/beaker/mnt/files/*.json\")):",
+                    "    materials = []",
+                    "    material_names = set()",
+                    "    path_material_mapping =  {}",
+                    "    uri_pattern = '/user/'",
+                    "    res = {}",
+                    "    for d in files:",
+                    "        with open(d) as json_file:",
+                    "                json_data = json.load(json_file)",
+                    "                simulation_cell = json_data['sections']['section_run-0']['sections']['section_system-0']['simulation_cell']",
+                    "                positions = json_data['sections']['section_run-0']['sections']['section_system-0']['atom_positions']",
+                    "                atom_labels = json_data['sections']['section_run-0']['sections']['section_system-0']['atom_labels']",
+                    "                material_name = ''.join(atom_labels)",
+                    "                path_material_mapping[material_name] = d",
+                    "                scaled_pos= np.dot(positions,conversion_ang_met)",
+                    "                scaled_sim_cell = np.dot(simulation_cell,conversion_ang_met)",
+                    "                atoms = Atoms(material_name,",
+                    "                          positions=scaled_pos,",
+                    "                          cell=scaled_sim_cell,",
+                    "                          pbc=True)",
+                    "                atoms.set_cell(scaled_sim_cell)",
+                    "                kwargs = {",
+                    "                        'radii'         : .85, # float, or a list with one float per atom",
+                    "                        'colors'        : None,# List: one (r, g, b) tuple per atom",
+                    "                        'show_unit_cell': 2,   # 0, 1, or 2 to not show, show, and show all of cell",
+                    "                    }",
+                    "                ",
+                    "                material_names.add(material_name)",
+                    "                write(material_name + '.png',atoms,**kwargs)",
+                    "",
+                    "    for name in material_names:",
+                    "        material = {",
+                    "            'name': name,",
+                    "            'json_path' : path_material_mapping[name].split('/')[-1],",
+                    "            'uri' : uri_pattern + name + '.png'",
+                    "        }",
+                    "        materials.append(material)",
+                    "    return materials",
+                    "",
+                    "def main():",
+                    "    path = '/home/beaker/.beaker/v1/web/'",
+                    "    ",
+                    "    os.chdir(path)",
+                    "    materials = getCrystalImage()",
+                    "    beaker.materials = materials",
+                    "",
+                    "beaker.materials = []",
+                    "main()",
+                    ""
+                ]
+            },
+            "output": {
+                "state": {},
+                "selectedType": "Hidden",
+                "pluginName": "Python3",
+                "shellId": "16A71C0AD6AB438D8E76218B2ADA9FC1",
+                "elapsedTime": 1227
+            },
+            "evaluatorReader": true,
+            "lineCount": 63,
+            "isError": false
+        },
+        {
+            "id": "code2iXvV3",
+            "type": "code",
+            "evaluator": "JavaScript",
+            "input": {
+                "body": [
+                    "materials = beaker.materials",
+                    "",
+                    "function myFunction() {",
+                    "    var input, filter;",
+                    "    input = document.getElementById(\"myInput\");",
+                    "    filter = input.value.toUpperCase();",
+                    "    ul = document.getElementById(\"myUL\");",
+                    "    ul.innerHTML = null;",
+                    "    for (i = 0; i < materials.length; i++) {",
+                    "      material = materials[i]",
+                    "      if (material.name.toUpperCase().indexOf(filter) > -1) ",
+                    "      {",
+                    "        var div_list = generate_div_material(material);",
+                    "        ul.appendChild(div_list);",
+                    "      }",
+                    "      if (filter.length ==0) {",
+                    "        ul.innerHTML = null;",
+                    "      }",
+                    "      ",
+                    "    }",
+                    "      ",
+                    "}",
+                    "beaker.selection_list = new Array();",
+                    "function save_selection(material)",
+                    "{",
+                    "  beaker.selection_list.push(material.json_path);",
+                    "}",
+                    "",
+                    "function generate_div_material(material)",
+                    "{  ",
+                    "  var div_list = document.createElement(\"div\");",
+                    "  var info_atoms = document.createElement(\"div\");",
+                    "  info_atoms.innerHTML = material.name;",
+                    "  var img_material = document.createElement(\"img\");",
+                    "  img_material.src = material.uri;",
+                    "  var botton = document.createElement(\"botton\");",
+                    "  botton.onclick = save_selection(material);",
+                    "  div_list.appendChild(info_atoms);",
+                    "  div_list.appendChild(img_material);",
+                    "  return div_list;",
+                    "}"
+                ]
+            },
+            "output": {
+                "state": {},
+                "result": [],
+                "selectedType": "Text",
+                "pluginName": "JavaScript",
+                "elapsedTime": 138,
+                "height": 55
+            },
+            "evaluatorReader": true,
+            "lineCount": 41,
+            "isError": false
+        },
+        {
+            "id": "code8k7oGs",
             "type": "code",
             "evaluator": "HTML",
             "input": {
                 "body": [
-                    "<p style=\"color: #20335d;;font-weight: 900; font-size: 22pt;\"> Band Structure Visualization</p>",
+                    "",
+                    "<p style=\"color: #20335d;;font-weight: 900; font-size: 22pt;\"> Graph Browser: Visualization of materials' properties </p>",
+                    "<p style=\"color: #20335d;;font-weight: 450; font-size: 14pt;\"> This tutorial aims at visulizing some information and important properties of NOMAD materials.</p>",
+                    "",
                     "<head>",
                     "<style>",
                     "* {",
@@ -90,53 +236,16 @@
                     "</style>",
                     "</head>",
                     "<body>",
-                    "",
-                    "<h2>Search Materials:</h2>",
+                    "<script language = \"javascript\">",
+                    "  var json_paths_selected= new Array();",
+                    "  function save_selection()",
+                    "    json_paths_selected.push",
+                    "</script>",
+                    "<h2>Search the materials:</h2>",
                     "",
                     "<input type=\"text\" id=\"myInput\" onkeyup=\"myFunction()\" placeholder=\"Keywords\" title=\"Type in a name\">",
                     "",
-                    "<ul id=\"myUL\">",
-                    "  <div style=\"display:none;\"><a href=\"#\">Ag (3 Structures)</a>",
-                    "    <p> space group 2 <tab4> 1 calculation </tab4> <tab4> <img src='/user/material.png'> </tab4></p> ",
-                    "    <p> space group 3 <tab4> 2 calculations </tab4> <tab4> <img src='/user/material2.png'> </tab4></p>  ",
-                    "  </div>",
-                    "  <div style=\"display:none;\"><a href=\"#\">Au Fe</a>",
-                    "    <p> space group 2 <tab4> 1 calculation </tab4> <tab4> <img src='/user/material3.png'> </tab4></p>",
-                    "  </div>",
-                    "  <li style=\"display:none;\"><a href=\"#\" class=\"header\">B</a></li>",
-                    "  <li style=\"display:none;\"><a href=\"#\">Be2 Au As</a></li>",
-                    "  <li style=\"display:none;\"><a href=\"#\">Be Te2 Re</a></li>",
-                    "",
-                    "  <li style=\"display:none;\"><a href=\"#\" class=\"header\">C</a></li>",
-                    "  <li style=\"display:none;\"><a href=\"#\">Cu Cs</a></li>",
-                    "  <li style=\"display:none;\"><a href=\"#\">Co Ni</a></li>",
-                    "  <li style=\"display:none;\"><a href=\"#\">Cu Fe</a></li>",
-                    "</ul>",
-                    "",
-                    "<script>",
-                    "function myFunction() {",
-                    "    var input, filter, ul, li, a, i;",
-                    "    input = document.getElementById(\"myInput\");",
-                    "    filter = input.value.toUpperCase();",
-                    "    ul = document.getElementById(\"myUL\");",
-                    "    li = ['Ag','Ag Au','A']",
-                    "    for (i = 0; i < li.length; i++) {",
-                    "      a = li[i].getElementsByTagName(\"a\")[0];",
-                    "      if (a.innerHTML.toUpperCase().indexOf(filter) > -1) {",
-                    "            li[i].style.display = \"\";",
-                    "        } else {",
-                    "            li[i].style.display = \"none\";",
-                    "",
-                    "        }",
-                    "      if (filter.length == 0) {",
-                    "          li[i].style.display = \"none\" ;1",
-                    "      }",
-                    "    }",
-                    "      ",
-                    "}",
-                    "</script>",
-                    "",
-                    "</body>"
+                    "<ul id=\"myUL\"></ul>"
                 ]
             },
             "output": {
@@ -144,162 +253,114 @@
                 "result": {
                     "type": "BeakerDisplay",
                     "innertype": "Html",
-                    "object": "<script>\nvar beaker = bkHelper.getBeakerObject().beakerObj;\n</script>\n<p style=\"color: #20335d;;font-weight: 900; font-size: 22pt;\"> Band Structure Visualization</p>\n\n<style>\n* {\n  box-sizing: border-box;\n}\n  \ntab1 { padding-left: 4em; }\ntab2 { padding-left: 8em; }\ntab3 { padding-left: 12em; }\ntab4 { padding-left: 16em; }\ntab5 { padding-left: 20em; }\n#myInput {\n  background-image: url('/css/searchicon.png');\n  background-position: 10px 12px;\n  background-repeat: no-repeat;\n  width: 100%;\n  font-size: 16px;\n  padding: 12px 20px 12px 40px;\n  border: 1px solid #ddd;\n  margin-bottom: 12px;\n}\n\n#myUL {\n  list-style-type: none;\n  padding: 0;\n  margin: 0;\n}\n\n#myUL li a {\n  border: 1px solid #ddd;\n  margin-top: -1px; /* Prevent double borders */\n  background-color: #f6f6f6;\n  padding: 12px;\n  text-decoration: none;\n  font-size: 18px;\n  color: black;\n  display: block\n}\n\n#myUL li a.header {\n  background-color: #e2e2e2;\n  cursor: default;\n}\n\n#myUL li a:hover:not(.header) {\n  background-color: #eee;\n}\n</style>\n\n\n\n<h2>Search Materials:</h2>\n\n<input type=\"text\" id=\"myInput\" onkeyup=\"myFunction()\" placeholder=\"Keywords\" title=\"Type in a name\">\n\n<ul id=\"myUL\">\n  <div style=\"display: none;\"><a href=\"#\">Ag (3 Structures)</a>\n    <p> space group 2 <tab4> 1 calculation </tab4> <tab4> <img src=\"/user/material.png\"> </tab4></p> \n    <p> space group 3 <tab4> 2 calculations </tab4> <tab4> <img src=\"/user/material2.png\"> </tab4></p>  \n  </div>\n  <div style=\"display: none;\"><a href=\"#\">Au Fe</a>\n    <p> space group 2 <tab4> 1 calculation </tab4> <tab4> <img src=\"/user/material3.png\"> </tab4></p>\n  </div>\n  <li style=\"display:none;\"><a href=\"#\" class=\"header\">B</a></li>\n  <li style=\"display:none;\"><a href=\"#\">Be2 Au As</a></li>\n  <li style=\"display:none;\"><a href=\"#\">Be Te2 Re</a></li>\n\n  <li style=\"display:none;\"><a href=\"#\" class=\"header\">C</a></li>\n  <li style=\"display:none;\"><a href=\"#\">Cu Cs</a></li>\n  <li style=\"display:none;\"><a href=\"#\">Co Ni</a></li>\n  <li style=\"display:none;\"><a href=\"#\">Cu Fe</a></li>\n</ul>\n\n<script>\nfunction myFunction() {\n    var input, filter, ul, li, a, i;\n    input = document.getElementById(\"myInput\");\n    filter = input.value.toUpperCase();\n    ul = document.getElementById(\"myUL\");\n    li = ul.getElementsByTagName(\"div\");\n    for (i = 0; i < li.length; i++) {\n      a = li[i].getElementsByTagName(\"a\")[0];\n      if (a.innerHTML.toUpperCase().indexOf(filter) > -1) {\n            li[i].style.display = \"\";\n        } else {\n            li[i].style.display = \"none\";\n\n        }\n      if (filter.length == 0) {\n          li[i].style.display = \"none\" ;\n      }\n    }\n      \n}\n</script>\n\n"
+                    "object": "<script>\nvar beaker = bkHelper.getBeakerObject().beakerObj;\n</script>\n\n<p style=\"color: #20335d;;font-weight: 900; font-size: 22pt;\"> Graph Browser: Visualization of materials' properties </p>\n<p style=\"color: #20335d;;font-weight: 450; font-size: 14pt;\"> This tutorial aims at visulizing some information and important properties of NOMAD materials.</p>\n\n\n<style>\n* {\n  box-sizing: border-box;\n}\n  \ntab1 { padding-left: 4em; }\ntab2 { padding-left: 8em; }\ntab3 { padding-left: 12em; }\ntab4 { padding-left: 16em; }\ntab5 { padding-left: 20em; }\n#myInput {\n  background-image: url('/css/searchicon.png');\n  background-position: 10px 12px;\n  background-repeat: no-repeat;\n  width: 100%;\n  font-size: 16px;\n  padding: 12px 20px 12px 40px;\n  border: 1px solid #ddd;\n  margin-bottom: 12px;\n}\n\n#myUL {\n  list-style-type: none;\n  padding: 0;\n  margin: 0;\n}\n\n#myUL li a {\n  border: 1px solid #ddd;\n  margin-top: -1px; /* Prevent double borders */\n  background-color: #f6f6f6;\n  padding: 12px;\n  text-decoration: none;\n  font-size: 18px;\n  color: black;\n  display: block\n}\n\n#myUL li a.header {\n  background-color: #e2e2e2;\n  cursor: default;\n}\n\n#myUL li a:hover:not(.header) {\n  background-color: #eee;\n}\n</style>\n\n\n<script language=\"javascript\">\n  var json_paths_selected= new Array();\n  function save_selection()\n    json_paths_selected.push\n</script>\n<h2>Search the materials:</h2>\n\n<input type=\"text\" id=\"myInput\" onkeyup=\"myFunction()\" placeholder=\"Keywords\" title=\"Type in a name\">\n\n<ul id=\"myUL\"><div><div>AsPPW</div><img src=\"/user/AsPPW.png\"></div><div><div>BePRh</div><img src=\"/user/BePRh.png\"></div></ul>"
                 },
                 "selectedType": "BeakerDisplay",
                 "elapsedTime": 0,
-                "height": 182
+                "height": 536
             },
             "evaluatorReader": true,
-            "lineCount": 98,
+            "lineCount": 64,
             "isError": false
         },
         {
-            "id": "coderSQwp4",
+            "id": "code6xieIl",
             "type": "code",
             "evaluator": "Python3",
             "input": {
                 "body": [
                     "import json",
-                    "from ase.lattice.cubic import BodyCenteredCubic",
-                    "from ase.io import write",
-                    "import numpy as np",
-                    "from ase import Atoms",
-                    "import os",
-                    "from IPython.display import Image",
+                    "import shutil",
                     "",
-                    "path_file = '/home/beaker/mnt/files/P71R4YILvjiPdm5JYWqm0CU3ytZa5.json'",
-                    "with open(path_file) as json_file:",
-                    "    json_data = json.load(json_file)",
-                    "simulation_cell = json_data['sections']['section_run-0']['sections']['section_system-0']['simulation_cell']",
-                    "positions = json_data['sections']['section_run-0']['sections']['section_system-0']['atom_positions']",
-                    "atom_labels = json_data['sections']['section_run-0']['sections']['section_system-0']['atom_labels']",
-                    "material = ''.join(atom_labels)",
-                    "path = '/home/beaker/.beaker/v1/web/'",
-                    "os.chdir(path)",
-                    "a = 1e10",
-                    "scaled_pos= np.dot(positions,a)",
-                    "scaled_sim_cell = np.dot(simulation_cell,a)",
-                    "atoms = Atoms(material,",
-                    "              positions=scaled_pos,",
-                    "              cell=scaled_sim_cell,",
-                    "              pbc=True)",
-                    "atoms.set_cell(scaled_sim_cell)",
-                    "kwargs = {",
-                    "    'radii'         : .85, # float, or a list with one float per atom",
-                    "    'colors'        : None,# List: one (r, g, b) tuple per atom",
-                    "    'show_unit_cell': 2,   # 0, 1, or 2 to not show, show, and show all of cell",
-                    "    }",
-                    "write('material3.png',atoms,**kwargs)"
-                ]
-            },
-            "output": {
-                "state": {},
-                "selectedType": "Hidden",
-                "pluginName": "Python3",
-                "shellId": "2EC9C3A273EB43769BF9E334FEBAB899",
-                "elapsedTime": 317
-            },
-            "evaluatorReader": true,
-            "lineCount": 31,
-            "isError": false
-        },
-        {
-            "id": "codey7beu6",
-            "type": "code",
-            "evaluator": "Python3",
-            "input": {
-                "body": [
-                    "import pandas as pd",
-                    "import datetime",
-                    "import os",
-                    "import numpy as np",
-                    "from pandas.compat import StringIO",
-                    "from pandas.io.common import urlopen",
-                    "from IPython.display import display, display_pretty, Javascript, HTML",
-                    "from pandas_highcharts.core import serialize",
-                    "from pandas_highcharts.display import display_charts",
-                    "import matplotlib.pyplot as plt",
                     "",
+                    "global TMP_PATH, MAIN_HTML, paths",
+                    "",
+                    "TMP_PATH = '/home/beaker/mnt/src/tmp'",
+                    "MAIN_HTML = 'band_comparison_min.html'",
                     "",
-                    "path_to_df = '/home/beaker/mnt/files/df.csv'",
-                    "df = pd.read_csv(path_to_df)",
-                    "columns = ['parserName','nBands','nUniqueGeo','nEigenvalues']",
-                    "df = df.filter(items=['parserName','nBands','nUniqueGeo','nEigenvalues'])",
-                    "new = []",
-                    "for index,row in df.iterrows():",
-                    "    for i in range(1,len(columns)):",
-                    "        value = df.ix[index][columns[i]]",
-                    "        df.ix[index][columns[i]] = int(value.replace(',',''))",
-                    "xAxis = np.array(df['parserName'])",
-                    "df1 = df[['parserName','nBands','nUniqueGeo']]",
-                    "print(df1)",
-                    "# ax = df[['nBands','nUniqueGeo']].plot(kind='bar', title =\"V comp\", figsize=(15, 10), legend=True, fontsize=12)"
+                    "paths = {}",
+                    "paths['dos_file2'] = '/home/beaker/mnt/files/P7KrLBThWzEjfiVecz5tHCUrLipC9.json'",
+                    "paths['band_file2'] = '/home/beaker/mnt/files/P71R4YILvjiPdm5JYWqm0CU3ytZa5.json'",
+                    "paths['dos_file'] = '/home/beaker/mnt/files/PgR5Fy-30BiJv7PI0KVwGbiLNpyrl.json'",
+                    "paths['band_file'] = '/home/beaker/mnt/files/PCuNgTdyFes7h6Ag2-jjRDkJ7wA7I.json'",
+                    "",
+                    "",
+                    "def load_jsonfile(path):",
+                    "    with open(path) as band_file:    ",
+                    "        return json.load(band_file)",
+                    "",
+                    "def genereate_tmpfiles(ident, paths):",
+                    "    tmpfile_names = {}",
+                    "    for k,v in paths.items():",
+                    "        tmpfile_name =  '%s/%s_%s.json' % (TMP_PATH, ident, k)",
+                    "        shutil.copy(v, tmpfile_name)",
+                    "        tmpfile_names[k] = tmpfile_name",
+                    "    return tmpfile_names",
+                    "    ",
+                    "        ",
+                    "        ",
+                    "def generate_link(uripaths):",
+                    "    params = [k+'='+v.split('/')[-1] for k,v in uripaths.items()]",
+                    "    return '%s?%s' % (MAIN_HTML,'&'.join(params))",
+                    "",
+                    "            ",
+                    "    ",
+                    "def main():",
+                    "    ident = hash(frozenset(paths.items()))",
+                    "    tmpfile_names = genereate_tmpfiles(ident, paths)",
+                    "    link = '/user/src/' + generate_link(tmpfile_names)",
+                    "    return link",
+                    "",
+                    "beaker.link = main()",
+                    "",
+                    ""
                 ]
             },
             "output": {
                 "state": {},
-                "result": {
-                    "type": "Results",
-                    "outputdata": [
-                        {
-                            "type": "out",
-                            "value": "               parserName  nBands nUniqueGeo\n0           FhiAimsParser     352    3983806\n1              CpmdParser       0         23\n2           VaspRunParser  262731   11568068\n3               AtkParser       0         73\n4              GpawParser       0        163\n5              QboxParser       0        672\n6           CrystalParser       0        118\n7            CastepParser       6       2734\n8                     Elk       0          0\n9   QuantumEspressoParser       0        921\n10           AbinitParser       0          8\n11           LammpsParser       0        105\n12        TurbomoleParser       0         14\n13             AsapParser       0        200\n14           OnetepParser       0         10\n15                 Wien2k       0          2\n16           SiestaParser       0         14\n17          OctopusParser       0         14\n18             Cp2kParser       0       7619\n19           DlPolyParser       0       1001\n20           GamessParser       0          0\n21             OrcaParser       0          0\n22         GaussianParser       0    3166078\n23                  Fleur       0          1\n24          RWwh1Nz4kdwTM       0          0\n25         ExcitingParser       0          8\n26             GulpParser       0          1\n27            Dmol3Parser       0        511\n28           NWChemParser       0       1268\n29         LibAtomsParser       0       9471\n"
-                        }
-                    ]
-                },
-                "selectedType": "Results",
+                "selectedType": "Hidden",
                 "pluginName": "Python3",
-                "shellId": "2EC9C3A273EB43769BF9E334FEBAB899",
-                "elapsedTime": 331,
-                "dataresult": "352",
-                "height": 513
+                "shellId": "16A71C0AD6AB438D8E76218B2ADA9FC1",
+                "elapsedTime": 121
             },
             "evaluatorReader": true,
-            "lineCount": 25,
+            "lineCount": 45,
             "isError": false
         },
         {
-            "id": "codecl8w3w",
+            "id": "code16Kx3a",
             "type": "code",
-            "evaluator": "Python3",
+            "evaluator": "HTML",
             "input": {
                 "body": [
-                    "",
-                    "data = \"\"\"Year,Software,Healthcare,Hardware,Biotech,Telecom,Manufacturing,Financial Products and Services,IT Services,Industrial/Energy,Retail,Media\\n2013-12-31,23.0,14.0,,11.0,,,7.0,,,7.0,16.0\\n2012-12-31,23.0,14.0,,11.0,,,,,7.0,12.0,7.0\\n2011-12-31,23.0,19.0,,13.0,,,,7.0,13.0,,5.0\\n2010-12-31,16.0,30.0,,15.0,,,,5.0,8.0,5.0,\\n2009-12-31,19.0,17.0,,8.0,,,5.0,,17.0,9.0,\\n2008-12-31,13.0,16.0,,11.0,,,,,8.0,12.0,7.0\\n2007-12-31,27.0,19.0,,12.0,,,,,8.0,6.0,5.0\\n2006-12-31,18.0,21.0,,18.0,,,6.0,,6.0,8.0,\\n2005-12-31,18.0,20.0,8.0,12.0,,,,6.0,6.0,,6.0\\n2004-12-31,22.0,16.0,10.0,10.0,6.0,,8.0,8.0,,7.0,\\n2003-12-31,26.0,13.0,12.0,11.0,5.0,12.0,,,,,\\n2002-12-31,40.0,14.0,5.0,5.0,5.0,,,,,,\\n\"\"\"",
-                    "df3 = pd.read_csv(StringIO(data), index_col=0, parse_dates=True)",
-                    "df3 = df3.fillna(0) / 100",
-                    "df4 = pd.DataFrame(df3.mean(), columns=['ratio'])",
-                    "print(df4.ratio)",
-                    "display_charts(df,kind='pie')"
+                    "<div>",
+                    "  <p style=\"color: #20335d;;font-weight: 500; font-size: 15pt;\"> For example, we could get the electronic structures visualized for the selected materials, and compare a pair of materials. </p>",
+                    "  <a href=\"#\" target=\"_blank\" class=\"btn btn-primary disabled\" id=\"show_btn\" >Show the band structures and density of states</a>",
+                    "</div>",
+                    "<script>",
+                    "$(\"#show_btn\").addClass(\"active\").removeClass(\"disabled\").attr(\"href\", beaker.link);",
+                    "</script>"
                 ]
             },
             "output": {
                 "state": {},
                 "result": {
-                    "type": "Results",
-                    "outputdata": [
-                        {
-                            "type": "out",
-                            "value": "Software                           0.223333\nHealthcare                         0.177500\nHardware                           0.029167\nBiotech                            0.114167\nTelecom                            0.013333\nManufacturing                      0.010000\nFinancial Products and Services    0.021667\nIT Services                        0.021667\nIndustrial/Energy                  0.060833\nRetail                             0.055000\nMedia                              0.038333\nName: ratio, dtype: float64\n"
-                        }
-                    ],
-                    "payload": "<div class=\"output_subarea output_html rendered_html\"><div id=\"chart_idOptHfDyJ\" <=\"\" div=\"\">\n    <script type=\"text/javascript\">new Highcharts.Chart({\"series\":[{\"yAxis\":0,\"name\":\"Index\",\"data\":[[0,0],[1,1],[2,2],[3,3],[4,4],[5,5],[6,6],[7,7],[8,8],[9,9],[10,10],[11,11],[12,12],[13,13],[14,14],[15,15],[16,16],[17,17],[18,18],[19,19],[20,20],[21,21],[22,22],[23,23],[24,24],[25,25],[26,26],[27,27],[28,28],[29,29]]}],\"xAxis\":{},\"chart\":{\"type\":\"pie\",\"renderTo\":\"chart_idOptHfDyJ\"},\"yAxis\":[{}],\"legend\":{\"enabled\":true}});</script></div></div>"
+                    "type": "BeakerDisplay",
+                    "innertype": "Html",
+                    "object": "<script>\nvar beaker = bkHelper.getBeakerObject().beakerObj;\n</script>\n<div>\n  <p style=\"color: #20335d;;font-weight: 500; font-size: 15pt;\"> For example, we could get the electronic structures visualized for the selected materials, and compare a pair of materials. </p>\n  <a href=\"/user/src/band_comparison_min.html?dos_file2=3134320750814483636_dos_file2.json&amp;band_file2=3134320750814483636_band_file2.json&amp;band_file=3134320750814483636_band_file.json&amp;dos_file=3134320750814483636_dos_file.json\" target=\"_blank\" class=\"btn btn-primary active\" id=\"show_btn\">Show the band structures and density of states</a>\n</div>\n<script>\n$(\"#show_btn\").addClass(\"active\").removeClass(\"disabled\").attr(\"href\", beaker.link);\n</script>"
                 },
-                "selectedType": "Results",
-                "pluginName": "Python3",
-                "shellId": "2EC9C3A273EB43769BF9E334FEBAB899",
-                "elapsedTime": 323,
-                "height": 622
+                "selectedType": "BeakerDisplay",
+                "elapsedTime": 0,
+                "height": 107
             },
             "evaluatorReader": true,
             "lineCount": 7,
             "isError": false
         },
         {
-            "id": "codeL8ZenJ",
+            "id": "code3b5iKD",
             "type": "code",
-            "evaluator": "Python3",
+            "evaluator": "HTML",
             "input": {
                 "body": [
                     ""
@@ -311,5 +372,45 @@
             "evaluatorReader": true
         }
     ],
-    "namespace": {}
+    "namespace": {
+        "materials": {
+            "type": "TableDisplay",
+            "subtype": "ListOfMaps",
+            "columnNames": [
+                "json_path",
+                "uri",
+                "name"
+            ],
+            "values": [
+                [
+                    "PgR5Fy-30BiJv7PI0KVwGbiLNpyrl.json",
+                    "/user/CoHfV.png",
+                    "CoHfV"
+                ],
+                [
+                    "Pt_ou8PywxbpHTV-YG78aKtNTDqcu.json",
+                    "/user/AsPPW.png",
+                    "AsPPW"
+                ],
+                [
+                    "P7KrLBThWzEjfiVecz5tHCUrLipC9.json",
+                    "/user/BePRh.png",
+                    "BePRh"
+                ],
+                [
+                    "P1etRNSyX01fCnpA_StJhXrC7bCpp.json",
+                    "/user/MnRhRhZn.png",
+                    "MnRhRhZn"
+                ]
+            ],
+            "types": [
+                "string",
+                "string",
+                "string"
+            ]
+        },
+        "selection_list": [],
+        "link": "/user/src/band_comparison_min.html?dos_file2=3134320750814483636_dos_file2.json&band_file2=3134320750814483636_band_file2.json&band_file=3134320750814483636_band_file.json&dos_file=3134320750814483636_dos_file.json"
+    },
+    "locked": true
 }
diff --git a/notebooks/seb_html_gen.bkr b/notebooks/seb_html_gen.bkr
new file mode 100644
index 0000000000000000000000000000000000000000..4adf1b21b252a078f65a6a5c65557c88cf72bd0b
--- /dev/null
+++ b/notebooks/seb_html_gen.bkr
@@ -0,0 +1,119 @@
+{
+    "beaker": "2",
+    "evaluators": [
+        {
+            "name": "HTML",
+            "plugin": "HTML",
+            "view": {
+                "cm": {
+                    "mode": "smartHTMLMode"
+                }
+            }
+        },
+        {
+            "name": "JavaScript",
+            "plugin": "JavaScript",
+            "view": {
+                "cm": {
+                    "mode": "javascript",
+                    "background": "#FFE0F0"
+                }
+            },
+            "languageVersion": "ES2015"
+        },
+        {
+            "name": "Python3",
+            "plugin": "Python3",
+            "setup": "%matplotlib inline\nimport numpy\nimport matplotlib\nfrom matplotlib import pylab, mlab, pyplot\nnp = numpy\nplt = pyplot\nfrom IPython.display import display\nfrom IPython.core.pylabtools import figsize, getfigs\nfrom pylab import *\nfrom numpy import *\n",
+            "view": {
+                "cm": {
+                    "mode": "python"
+                }
+            }
+        }
+    ],
+    "cells": [
+        {
+            "id": "codeEyjQTB",
+            "type": "code",
+            "evaluator": "Python3",
+            "input": {
+                "body": [
+                    "from IPython.core.display import display, HTML",
+                    "import htmlPy",
+                    "",
+                    "",
+                    "h = HTML('''",
+                    "",
+                    "<script type=\"application/json\" id=\"\">",
+                    "    {",
+                    "        \"unicorns\": \"awesome\",",
+                    "        \"abc\": [1, 2, 3]",
+                    "    }",
+                    "    ",
+                    "</script>",
+                    "<script>var stuff = JSON.parse(document.getElementById('stuff').innerHTML);",
+                    "document.getElementById('a').innerHTML = JSON.stringify(stuff)",
+                    "</script>",
+                    "<div id='a'></div>",
+                    "'''        ",
+                    "         )",
+                    "#display(h)",
+                    ""
+                ]
+            },
+            "output": {
+                "state": {},
+                "result": {
+                    "type": "BeakerDisplay",
+                    "innertype": "Error",
+                    "object": [
+                        "No module named &apos;PySide&apos;",
+                        "No module named &apos;PySide&apos;<br><span  class=\"ansired\">---------------------------------------------------------------------------</span><br><span  class=\"ansired\">ImportError</span>                               Traceback (most recent call last)<br><span  class=\"ansigreen\">&lt;ipython-input-1-307ef53c7a70&gt;</span> in <span  class=\"ansicyan\">&lt;module&gt;<span  class=\"ansiblue\">()</span>\n<span  class=\"ansigreen\">      1</span> <span  class=\"ansigreen\">from</span> IPython<span  class=\"ansiblue\">.</span>core<span  class=\"ansiblue\">.</span>display <span  class=\"ansigreen\">import</span> display<span  class=\"ansiblue\">,</span> HTML<span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">----&gt; 2<span  class=\"ansired\"> <span  class=\"ansigreen\">import</span> htmlPy<span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">      3</span> <span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">      4</span> <span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">      5</span> h = HTML(&apos;&apos;&apos;\n<br><span  class=\"ansigreen\">/home/beaker/py3k/lib/python3.4/site-packages/htmlPy/__init__.py</span> in <span  class=\"ansicyan\">&lt;module&gt;<span  class=\"ansiblue\">()</span>\n<span  class=\"ansigreen\">      2</span> unicode <span  class=\"ansiblue\">=</span> str <span  class=\"ansigreen\">if</span> sys<span  class=\"ansiblue\">.</span>version_info <span  class=\"ansiblue\">&gt;=</span> <span  class=\"ansiblue\">(</span><span  class=\"ansicyan\">3</span><span  class=\"ansiblue\">,</span> <span  class=\"ansicyan\">0</span><span  class=\"ansiblue\">)</span> <span  class=\"ansigreen\">else</span> unicode<span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">      3</span> <span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">----&gt; 4<span  class=\"ansired\"> <span  class=\"ansigreen\">from</span> PySide<span  class=\"ansiblue\">.</span>QtCore <span  class=\"ansigreen\">import</span> QObject <span  class=\"ansigreen\">as</span> Object<span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">      5</span> <span  class=\"ansigreen\">from</span> PySide<span  class=\"ansiblue\">.</span>QtCore <span  class=\"ansigreen\">import</span> Slot<span  class=\"ansiblue\"></span>\n<span  class=\"ansigreen\">      6</span> <span  class=\"ansigreen\">from</span> <span  class=\"ansiblue\">.</span>base_gui <span  class=\"ansigreen\">import</span> BaseGUI<span  class=\"ansiblue\"></span>\n<br><span  class=\"ansired\">ImportError</span>: No module named &apos;PySide&apos;"
+                    ]
+                },
+                "selectedType": "BeakerDisplay",
+                "pluginName": "Python3",
+                "shellId": "1BB843F0F56D46468C62856172838D3B",
+                "elapsedTime": 415,
+                "height": 81
+            },
+            "evaluatorReader": true,
+            "lineCount": 21,
+            "isError": true
+        },
+        {
+            "id": "codevNb1zt",
+            "type": "code",
+            "evaluator": "HTML",
+            "input": {
+                "body": [
+                    "<html>",
+                    "<table>",
+                    "  <tr>",
+                    "    <td>",
+                    "    </td>",
+                    "  </tr>",
+                    "  </table>",
+                    "",
+                    "</html>"
+                ]
+            },
+            "output": {
+                "state": {},
+                "result": {
+                    "type": "BeakerDisplay",
+                    "innertype": "Html",
+                    "object": "<script>\nvar beaker = bkHelper.getBeakerObject().beakerObj;\n</script>\n\n<table>\n  <tbody><tr>\n    <td>\n    </td>\n  </tr>\n  </tbody></table>\n\n"
+                },
+                "selectedType": "BeakerDisplay",
+                "elapsedTime": 1,
+                "height": 51
+            },
+            "evaluatorReader": true,
+            "lineCount": 9,
+            "isError": false
+        }
+    ],
+    "namespace": {}
+}
diff --git a/src/band_comparison_min.html b/src/band_comparison_min.html
index 7abb3dc5bc793913a3f2b61cb2b45c34884257c9..8c6d60eefbdc64b9018066fe256b9d331b1f2d6e 100644
--- a/src/band_comparison_min.html
+++ b/src/band_comparison_min.html
@@ -18,124 +18,161 @@
 		<script language="javascript" type="text/javascript" src="flot/jquery.flot.canvas.js"></script>
 		<script language="javascript" type="text/javascript" src="flot/jquery.colorhelpers.js"></script>
 		<script language="javascript" type="text/javascript" src="flot/jquery.flot.selection.js"></script>
-		<!--<script language="javascript" type="text/javascript" src="flot/jquery.flot.navigate.js"></script>-->
-
-
-
-		<!--<script language="javascript" type="text/javascript" src="canvas2image.js"></script>-->
-		
+		<!--<script language="javascript" type="text/javascript" src="flot/jquery.flot.navigate.js"></script>
+		<script language="javascript" type="text/javascript" src="canvas2image.js"></script>-->
 		<script type="text/javascript" src="flot/jquery.flot.labels.js"></script>  
-		
-		<link href="band_flot.css" rel="stylesheet" type="text/css">
-
-
-
-
-		<!--<script src="js/jquery-1.min.js"></script>-->
 		<script src="js/jquery.event.move.js"></script>
 		<script src="js/jquery.twentytwenty.js"></script>
-
-
-		<script type="text/javascript"src="main.js"> </script>
-		<script>initiate()</script>
-
-
-		<script type="text/javascript"src="plot_band_dos.js"> </script>
-
+		
+		<script type="text/javascript" src="initiate.js"> </script>
+		<link href="band_flot.css" rel="stylesheet" type="text/css">
+		<script type="text/javascript" src="plot_band_dos.js"> </script>
+		<script src="band_tools.js"></script>
 
 		<!-------Comparison of two band structures-->
 		<!--<link href="css/foundation.css" rel="stylesheet" type="text/css" />-->
-		<link href="css/twentytwenty.css" rel="stylesheet" type="text/css" />
+		<link href="css/twentytwenty.css" rel="stylesheet" type="text/css" />		
 
 	</head>
-	<body >
+	<body>
 		<pre id="output"></pre>
-		<div id="headline1_vis" style = "padding-left:5%; font-family: Arial; font-size: 230%; font-weight: 900; color: #000">Band structure and density of states</div>
-		<table>
-			<tr><td>
-		<div style = "padding-left:5%; padding-top: 30px; font-family: Arial; font-size: 140%; font-weight: 500; color: #000">System information</div>
-		<div style = "padding-left:10%; padding-top: 5px; font-family: Arial; font-size: 100%; "> 
-			<p><b>Material:</b> XXXX </p>
-			<p><b>Code:</b> XXXX</p>
-		</div>
+		<div id="headline1_vis" style = "padding-left:5%; font-family: Arial; font-size: 230%; font-weight: 900; color: #000">Band structures and density of states</div>
 		<div id="miniature" style="width:100%; height: 1px; float:left; border-top: 1px solid #888888; background: url(img/bg-toolbar.gif); margin-top: 25px; "></div>
-		<div id="description1_vis"></div>
-		<div class="demo-container_vis" style = "padding-left:5%;">
-			<div id="placeholder" class="demo-placeholder"></div>
-			<div id="placeholder2" class="demo-placeholder2"></div>
-		</div>  
-		<div id="toolbar" style="width:100%; height: 350px; float:left; border-top: 1px solid #888888; border-bottom: 1px solid #888888; background: url(img/bg-toolbar.gif); margin-top: 25px; ">
-			<!---moz-box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05);
-			-webkit-box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05);
-			box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05)">-->
-			<div id = "select_zoom" style = "width:100%; height:10px; float: left; margin-left: 80px; margin-top: 15px; font-size: 17px; font-family: Arial">
-				Select and zoom:  <img src="img/select_zoom_0.png" width="18" height="18" border="0">  </img>
-				<p></p>
-			</div>
-			<div id="overview" style="width:300px;height:200px; margin-left:60px; margin-top: 50px; padding-top: 0px"></div>
-
-			<p id="overviewLegend" style="margin-left:10px"></p>
-			<!--
-			<div style = "width: 100px; height: 25px; margin-top: -200px; margin-left:300px; font-size: 0.8em; font-family: Arial">
-				<div style = "width: 25px; height: 25px; border: 1px dashed #8888; margin-top: 10px; margin-left:90px; font-size: 0.8em; font-family: Arial">
-					<a href=# title="Select and zoom"><img src="img/Select_zoom.png" width="25" height="25" border="0"></a>
-					<a href="" title="Select and zoom" onMouseOver="On(0)" onMouseOut="Off(0)"><img src="img/Select_Zoom.png" width="25" height="25" border="0" name="img0"></a>
-				</div>
-			</div>
-			-->
-			<div style = "margin-left: 20px;">    
-				<button id="save_band_img" onclick = "save_band()">Export band structure as image</button>
-				<button id="save_dos_img" onclick = "save_dos()">Export DOS as image</button> 
-                <!--<button id="save_all_img" onclick = "save_all()">Export image</button>-->
-                <button id="save_dos_img" onclick = "reset()">Reset</button> 
-                <button id="save_dos_img" onclick = "autoscale()">Autoscale</button> 
-                
-				
-				<!--<select id="selections">
-					<option value="png">png</option>
-					<option value="jpeg">jpeg</option>
-					<option value="bmp">bmp</option>
-				</select><br/>
-				width : <input type="number" value="300" id="img_Width" /><br/>
-				height : <input type="number" value="200" id="img_Height" />
-                display:none;
-                style="display: none;"
-				-->
-			</div>
-		
-		</div>
-
-		</td>
-		<td>
-
-		<!-----The 2nd band structure---------------->
-		<div class="demo-container_vis" style = "padding-left:5%; display = 'inline';">
-			<div id="placeholder3" class="demo-placeholder"></div>
-			<div id="placeholder4" class="demo-placeholder2"></div>
+		<!--<div style = "padding-left:5%; padding-top: 50px; font-family: Arial; font-size: 140%; font-weight: 500; color: #000">System information</div>-->
+		<table>
+			<tr>
+				<td>
+					<div id="description1_vis"></div>
+					<div class="demo-container_vis" style = "padding-left:5%;">
+						<div id="placeholder_band" class="demo-placeholder"></div>
+						<div id="placeholder_dos" class="demo-placeholder2"></div>
+					</div>  
+					<div id="toolbar" style="width:100%; height: 350px; float:left; border-top: 1px solid #888888; border-bottom: 1px solid #888888; background: url(img/bg-toolbar.gif); margin-top: 25px; ">
+						<table>
+							<tr>
+								<td>
+									<!---moz-box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05);
+									-webkit-box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05);
+									box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05)">-->
+									<div id = "select_zoom" style = "width:100%; height:10px; float: left; margin-left: 80px; margin-top: 15px; font-size: 17px; font-family: Arial">
+										Select and zoom:  <img src="img/select_zoom_0.png" width="18" height="18" border="0">  </img>
+										<p></p>
+									</div>
+									<div id="overview" style="width:300px;height:200px; margin-left:60px; margin-top: 50px; padding-top: 0px"></div>
+									<p id="overviewLegend" style="margin-left:10px"></p>
+								</td>
+								<td>
+									<div style = "padding-left:20px; padding-top: 50px; font-family: Arial; font-size: 100%; "> 
+										<div id = "atom_labels_1" style = "padding-top: 15px;">Atom labels:</div>
+										<div id = "program_name_1" style = "padding-top: 15px;">Code:</div>
+										<div id = "program_basis_set_type_1" style = "padding-top: 15px;">Basis set:</div>
+										<div id = "XC_functional_name_1" style = "padding-top: 15px;"></div>
+									</div>
+								</td>
+							</tr>
+						</table>
+						<div style = "margin-left: 20px;">    
+							<button id="save_band_img" onclick = "save_band()" class = "botton_style">Export band structure as image</button>
+							<button id="save_dos_img" onclick = "save_dos()" class = "botton_style">Export DOS as image</button> 
+							<!--<button id="save_all_img" onclick = "save_all()">Export image</button>-->
+							<button id="reset" onclick = "reset(1)" class = "botton_style">Reset</button> 
+							<button id="autoscale" onclick = "autoscale(1)" class = "botton_style">Autoscale</button> 
+							
+			
+							<!--<select id="selections">
+								<option value="png">png</option>
+								<option value="jpeg">jpeg</option>
+								<option value="bmp">bmp</option>
+							</select><br/>
+							width : <input type="number" value="300" id="img_Width" /><br/>
+							height : <input type="number" value="200" id="img_Height" />
+							display:none;
+							style="display: none;"
+							-->
+						</div>
+					
+					</div>
+				</td>
+				<td>
+					<!-----The 2nd band structure---------------->
+					<div id="description1_vis"></div>
+					<div class="demo-container_vis" style = "padding-left:5%; display = 'inline';">
+						<div id="placeholder_band2" class="demo-placeholder"></div>
+						<div id="placeholder_dos2" class="demo-placeholder2"></div>
+					</div> 
+					<div id="toolbar" style="width:100%; height: 350px; float:left; border-top: 1px solid #888888; border-bottom: 1px solid #888888; background: url(img/bg-toolbar.gif); margin-top: 25px; ">
+						<table>
+							<tr>
+								<td>
+									<!---moz-box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05);
+									-webkit-box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05);
+									box-shadow: inset 0 5px 5px rgba(0, 0, 0, 0.05), inset 0 -2px 2px rgba(0, 0, 0, 0.05)">-->
+									<div id = "select_zoom" style = "width:100%; height:10px; float: left; margin-left: 80px; margin-top: 15px; font-size: 17px; font-family: Arial">
+										Select and zoom:  <img src="img/select_zoom_0.png" width="18" height="18" border="0">  </img>
+										<p></p>
+									</div>
+									<div id="overview2" style="width:300px;height:200px; margin-left:60px; margin-top: 50px; padding-top: 0px"></div>
+									<p id="overviewLegend2" style="margin-left:10px"></p>
+								</td>
+								<td>
+									<div style = "padding-left:20px; padding-top: 50px; font-family: Arial; font-size: 100%; "> 
+										<div id = "atom_labels_2" style = "padding-top: 15px;"></div>
+										<div id = "program_name_2" style = "padding-top: 15px;"></div>
+										<div id = "program_basis_set_type_2" style = "padding-top: 15px;"></div>
+										<div id = "XC_functional_name_2" style = "padding-top: 15px;"></div>
+									</div>
+								</td>
+							</tr>
+						</table>
+						<div style = "margin-left: 20px;">    
+							<button id="save_band_img" onclick = "save_band()" class = "botton_style">Export band structure as image</button>
+							<button id="save_dos_img" onclick = "save_dos()" class = "botton_style">Export DOS as image</button> 
+							<!--<button id="save_all_img" onclick = "save_all()">Export image</button>-->
+							<button id="reset" onclick = "reset(2)" class = "botton_style">Reset</button> 
+							<button id="autoscale" onclick = "autoscale(2)" class = "botton_style">Autoscale</button> 
+							
+			
+							<!--<select id="selections">
+								<option value="png">png</option>
+								<option value="jpeg">jpeg</option>
+								<option value="bmp">bmp</option>
+							</select><br/>
+							width : <input type="number" value="300" id="img_Width" /><br/>
+							height : <input type="number" value="200" id="img_Height" />
+							display:none;
+							style="display: none;"
+							-->
+						</div>
+					
+					</div>
+
+				</td>
+			</tr>
+		</table>
+		<!-----Comparison of two band structures----->
+		<div style = "margin-left:5%; padding-top:20px; font-family: Arial; font-size: 230%; font-weight:900">
+			Comparison of two materials
 		</div>
 
-		<div style="margin-left:5%; margin-top: 5em; width: 600px;">
-			<div style = "font-family: Arial; font-size: 100%">
-				<p>Choose the second material to compare the band structures.</p>
-			</div>
-			<div><button onclick = "plot_2nd_band()">Get</button> </div>
-			<!--<div><button onclick = "hide_2nd_band()">hide</button> </div>-->
-
-			<div style = "font-family: Arial; font-size: 100%">
-				<p>Drag and see the differences between the band structures of two materials.</p>
-			</div>
-			<div><button onclick = "image_comparison()">Compare</button> </div>
+		<div style="margin-left:5%; margin-top: 20px; width: 600px;">
+			<table>
+				<tr>
+					<!--<div><button onclick = "plot_2nd_band()">Get</button> </div>
+					<div><button onclick = "hide_2nd_band()">hide</button> </div>-->
+					<td>
+						<div style = "font-family: Arial; font-size: 100%">
+							<p>Drag and see the differences between the band structures of two materials.</p>
+						</div>
+					</td>
+					<td>
+						<div><button onclick = "image_comparison();" class = "botton_style_large">Compare</button> </div>
+					</td>
+				</tr>
+			</table>
 			<div>
-				<div id="img_comparison" class="twentytwenty-container">
-
-					<!--<img src = image_band />-->			
-					<!--<img id="img_compare_1"/> src="img/1_1.jpg" />-->
-					<!--<img id="img_compare_2"/>  src="img/1_2.jpg" />-->
-				</div>
+				<div id="img_comparison" class="twentytwenty-container" ></div>
 			</div>
 		</div>
-		</tr>
-		</table>
 		
 		
 
@@ -150,3 +187,4 @@
 	</body>
 
 </html>
+
diff --git a/src/band_flot.css b/src/band_flot.css
index c1a9b2ec6a8bd6b53f3dfd00b69a97922955ef95..6db7acb46a31bfecac9d8d912d3563bc2e57ddf8 100644
--- a/src/band_flot.css
+++ b/src/band_flot.css
@@ -11,10 +11,10 @@
 }
 .demo-container_vis {
 	box-sizing: border-box;
-	width: 800px;
-	height: 500px;
+	width: 700px;
+	height: 450px;
 	padding-left: 20px;
-	padding-top: 50px;
+	padding-top: 10px;
 	padding-right: 1em;
 	margin: 0;
 	border: 0;
@@ -24,7 +24,7 @@
 .demo-placeholder {
 	font-family: Verdana,Arial,sans-serif;
 	font-size: 0.875em;
-	width: 74%;
+	width: 76%;
 	height: 100%;
 	background-color: #fff;
 	float:left;
@@ -33,10 +33,11 @@
 .demo-placeholder2 {
 	font-family: Verdana,Arial,sans-serif;
 	font-size: 0.875em;
-	width: 26%;
+	width: 24%;
 	height: 100%;
 	background-color: #fff;
 	float:left;
+	padding-left: 0px;
 }
 
 .demo-placeholder_overview_text {
@@ -185,3 +186,14 @@
   height: 800px;
   background-color: #fff;
 }*/
+.botton_style{
+	height:30px;
+	border:2px blue none;
+	background-color: #d6dfe3
+}
+.botton_style_large{
+	width:100px;
+	height:40px;
+	border:2px blue none;
+	background-color: #d6dfe3
+}
diff --git a/src/band_tools.js b/src/band_tools.js
new file mode 100644
index 0000000000000000000000000000000000000000..42c23296cdc0cab0e08fea12c36fb3c990f3ff2f
--- /dev/null
+++ b/src/band_tools.js
@@ -0,0 +1,172 @@
+
+plot_band_dos_main(band_file_1, dos_file_1, "#placeholder_band", "#placeholder_dos", "#overview", upperLim, lowerLim);
+plot_band_dos_main(band_file_2, dos_file_2, "#placeholder_band2", "#placeholder_dos2", "#overview2", upperLim, lowerLim);
+
+
+//Parameters for plotting
+/*
+
+
+var top_band_bottum = 100.0;
+var bottum_band_top = -1000.0;
+
+var image_band;
+var image_band_1, image_band_2;//for comparison
+var image_dos_1, image_dos_2;
+var image_combined;
+
+var circleoff;
+var circleon;
+if(document.images){
+	circleoff=new Image(50,50);
+	circleoff.src="img/Select_Zoom.png";
+	circleon=new Image(50,50);
+	circleon.src="img/Select_Zoom.png";
+}
+function On(name){
+	if(document.images){
+		document.images['img'+name].src=circleon.src;
+	}
+}
+function Off(name){
+	if(document.images){
+		document.images['img'+name].src=circleoff.src;
+	}
+}
+*/
+function save_band()
+{
+	document.location.href = image_band;
+	/*
+	//ctx = canvas.getContext('2d');
+
+	$save = document.getElementById('save');
+	$selections = document.getElementById('selections');
+	
+	//$imgs = document.getElementById('imgs');
+	$img_W= document.getElementById('img_Width');
+	$img_H = document.getElementById('img_Height');
+	var type = $selections.value;
+	var w = $img_W.value;
+	var h = $img_H.value;
+	//alert("img sizes: " + w + "X" + h);
+	Canvas2Image.saveAsImage(canvas, w, h, type, 'customName');
+	//alert("end function save_img_bind");
+	*/
+}
+function save_dos()
+{
+	document.location.href = image_dos;
+}
+function save_all()
+{
+	//Get a combined canvas for both band and dos
+	//var c = document.createElement("canvas"); 
+	var c=document.getElementById("myCanvas");
+	var ctx =  c.getContext("2d"); 
+	var imageObj1 = new Image();
+	var imageObj2 = new Image();
+	imageObj1.src = image_band; 
+	ctx.drawImage(imageObj1, 0, 0);
+	imageObj2.src = image_dos;
+	ctx.drawImage(imageObj2, 600, 0);
+	image_combined = c.toDataURL(); 
+	image_combined = image_combined.replace("image/png","image/octet-stream");
+	document.location.href = image_combined;
+}
+function autoscale(ID)
+{
+	var placeholder_band;
+	var placeholder_dos;
+	var placeholder_overview;
+	
+	if(ID == 1)
+	{
+		placeholder_band = "#placeholder_band";
+		placeholder_dos = "#placeholder_dos";
+		placeholder_overview = "#overview";
+	}
+	else if(ID == 2)
+	{
+		placeholder_band = "#placeholder_band2";
+		placeholder_dos = "#placeholder_dos2";
+		placeholder_overview = "#overview2";
+	}
+	else
+		alert('Autoscale: div not found!');
+	band_file = band_file_obj[placeholder_band];
+	dos_file = dos_file_obj[placeholder_band];
+	//alert('band file: '+band_file + '  dos_file:'+dos_file);
+	//alert(placeholder_band + placeholder_dos);
+	upperLim = top_band_bottum[placeholder_band];
+	//alert('upperlim:   '+upperLim);
+	lowerLim = -10.01;
+	//lowerLim = bottum_band_top;
+	////alert('bottum_band_top: '+bottum_band_top);
+	plot_band_dos_main(band_file, dos_file, placeholder_band, placeholder_dos, placeholder_overview, upperLim, lowerLim);
+}
+function reset(ID)
+{
+	var placeholder_band;
+	var placeholder_dos;
+	var placeholder_overview;
+	
+	if(ID == 1)
+	{
+		placeholder_band = "#placeholder_band";
+		placeholder_dos = "#placeholder_dos";
+		placeholder_overview = "#overview";
+	}
+	else if(ID == 2)
+	{
+		placeholder_band = "#placeholder_band2";
+		placeholder_dos = "#placeholder_dos2";
+		placeholder_overview = "#overview2";
+	}
+	else
+		alert('Autoscale: div not found!');
+	band_file = band_file_obj[placeholder_band];
+	dos_file = dos_file_obj[placeholder_band];
+	//alert('band file: '+band_file + '  dos_file:'+dos_file);
+	//alert(placeholder_band + placeholder_dos);
+	upperLim = 10.01;
+	lowerLim = -10.01;
+	plot_band_dos_main(band_file, dos_file, placeholder_band, placeholder_dos, placeholder_overview, upperLim, lowerLim);
+}
+/*
+function plot_2nd_band()
+{
+	//document.getElementById("#placeholder3").style.display = 'inline';
+	main_div_band = "#placeholder3";
+	main_div_dos = "#placeholder4";
+	band_file = band_file_original_2;
+	dos_file = dos_file_original_2;
+	upperLim = 10.01;
+	lowerLim = - 10.01;
+	$.getJSON(band_file, get_band_data);
+}
+*/
+/*
+function hide_2nd_band()
+{
+	document.getElementById("#placeholder3").style.display = 'none';
+}
+*/
+function image_comparison(){
+
+	////alert(image_band_1);
+	////alert(image_band_2);
+	var url_1 = image_band_1;
+	var url_2 = image_band_2;
+	var img_1 = document.createElement("img");
+	img_1.src=url_1;//"img/1_1.jpg";
+	document.getElementById("img_comparison").appendChild(img_1);
+	var img_2 = document.createElement("img");
+	img_2.src=url_2;//"img/1_2.jpg";
+	document.getElementById("img_comparison").appendChild(img_2);
+
+	
+	$(".twentytwenty-container[data-orientation!='vertical']").twentytwenty({default_offset_pct: 0.7});
+	$(".twentytwenty-container[data-orientation='vertical']").twentytwenty({default_offset_pct: 0.3, orientation: 'vertical'});
+}
+
diff --git a/src/initiate.js b/src/initiate.js
new file mode 100644
index 0000000000000000000000000000000000000000..b868a25980df12660b89614c69da7e2d5b821966
--- /dev/null
+++ b/src/initiate.js
@@ -0,0 +1,40 @@
+params={};
+window.location.search.replace(/[?&]+([^=&]+)=([^&]*)/gi,
+	function(str,key,value) {
+		params[key] = value;
+	});
+
+base = "/user/src/tmp/"	
+//----------------Input files -------------------------------
+band_file_original_1 = base + params['band_file'];
+band_file_original_2 = base + params['band_file2'];
+dos_file_original_1 = base + params['dos_file'];
+dos_file_original_2 = base + params['dos_file2'];
+//var dos_file = 'data/P1etRNSyX01fCnpA_StJhXrC7bCpp.json';
+//-----------------------------------------------------------
+
+
+var band_file_1 = band_file_original_1;
+var dos_file_1 = dos_file_original_1;
+var band_file_2 = band_file_original_2;
+var dos_file_2 = dos_file_original_2;
+
+var band_file_obj = {};
+var dos_file_obj  = {};
+
+var upperLim = 10.01;
+var lowerLim = - 10.01;
+
+
+var top_band_bottum = {};
+var bottum_band_top = {};
+
+var bands_1 = new Array(); // To record the initial band data for each material
+var bands_2 = new Array();
+var dos_1 = new Array();
+var dos_2 = new Array();
+
+band_file_obj['#placeholder_band'] = band_file_original_1;
+dos_file_obj['#placeholder_band'] = dos_file_original_1;
+band_file_obj['#placeholder_band2'] = band_file_original_2;
+dos_file_obj['#placeholder_band2'] = dos_file_original_2;
\ No newline at end of file
diff --git a/src/plot_band_dos.js b/src/plot_band_dos.js
index 8593ad798783c812abe0591d0c5be795504614af..652497ec357fc685fd56fe5d88a3ef610f4f1d03 100644
--- a/src/plot_band_dos.js
+++ b/src/plot_band_dos.js
@@ -39,13 +39,51 @@ function view_data(data)
 	return inventoryJSONTextAgain;
 }
 
+function pad(n, width, z) {
+	z = z || '0';
+	n = n + '';
+	return n.length >= width ? n : new Array(width - n.length + 1).join(z) + n;
+};
+
+function get_label_flag(array)
+	{
+		////window.//////alert('x, y, z:' + array);
+		if (array.toString() == [0, 0.5, 0.5].toString())
+		{
+			return "X";
+		}
+		else if (array.toString() == [0.5, 0.5, 0.5].toString())
+		{
+			return "L";
+		}
+		else if (array.toString() == [0.375, 0.375, 0.75].toString())
+		{
+			return "K";
+		}
+		else if (array.toString() == [0.25, 0.5, 0.75].toString())
+		{
+			return "W";
+		}
+		else if (array.toString() == [0, 0, 0].toString())
+		{
+			return "\u0393";
+		}
+		else if (array.toString() == [0.25, 0.625, 0.625].toString())
+		{
+			return "U";
+		}
+		else
+		{
+			return "?";
+		}
+	}
 //------------------------------------------
 
 //===================Get the labels for x axis======================================
 
 
 
-function plot_band_dos_main(band_file, dos_file, placeholder_band, placeholder_dos)
+function plot_band_dos_main(band_file, dos_file, placeholder_band, placeholder_dos, placeholder_overview, upperLim, lowerLim)
 {
 	/*
 	 * should be called from div:
@@ -55,34 +93,34 @@ function plot_band_dos_main(band_file, dos_file, placeholder_band, placeholder_d
 	 */
 	var image_band;
 	var image_dos;
-	var origData = {};
-	var DOSdata = {};
+	var band_data_obj = {};
+	var dos_data_obj = {};
 	var HomoLumodata = {};
 	var E_top_valence = 0.0;
 	var band_gap_indirect = 0.0;
 
 	//Process the band data
 	$.getJSON(band_file, function(band_data){
-		get_band_data(band_data);
-		alert(view_data(HomoLumodata));
+		band_data_obj = get_band_data(band_data, placeholder_band);
+		////////alert(view_data(HomoLumodata));
+		E_top_valence = band_data_obj["E_top_valence"];
 
-		
 		//Process the dos data
 		$.getJSON(dos_file, function(dos_data){
-			get_dos_data(dos_data, E_top_valence);
+			dos_data_obj = get_dos_data(dos_data, E_top_valence);
 			
 			//Plot with flot
-			plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos);
+			plot_band_dos_flot(band_data_obj, dos_data_obj, placeholder_band, placeholder_dos, placeholder_overview, upperLim, lowerLim);
 			
-		});
-	});
+		});//getJSON(dos)
+	});//getJSON(band)
 
 }
 
 
-function get_band_data(band_data)
+function get_band_data(band_data, placeholder_band)
 {
-
+	var band_data_obj = {};
 	var N_bands = 0;
 	var k_coor_1D = new Array(); //k_coor_1D[N_k_points_all]: Coordinates of k points in 1 dimension
 	var N_k_points_all = 0;
@@ -98,7 +136,7 @@ function get_band_data(band_data)
 
 	//Get the number of k band segments
 	var N_k_band_segments = section_k_band_segment.length;
-	//alert('Number of k band segments: '+ N_k_band_segments); 
+	////////alert('Number of k band segments: '+ N_k_band_segments); 
 
 	//--------Get the x axis for the band structure figure: the coordinates of k points in 1D-------------
 	//output: k_coor_1D[N_k_points_all]
@@ -108,26 +146,26 @@ function get_band_data(band_data)
 
 	for(var i_segments = 0; i_segments < N_k_band_segments; i_segments++)
 	{
-		////window.alert(band_energy)
+		////window.//////alert(band_energy)
 		var band_k_points = section_k_band_segment[i_segments].band_k_points;
-		////window.alert('band_k_points.length'+band_k_points.length);
-		////window.alert(band_k_points);
+		////window.//////alert('band_k_points.length'+band_k_points.length);
+		////window.//////alert(band_k_points);
 		for(var i_k_points = 0; i_k_points < band_k_points.length; i_k_points++) //band_k_points.length: number of k points in current segment
 		{
-			////window.alert('j='+j+'band_k_points[j]='+band_k_points[j])
+			////window.//////alert('j='+j+'band_k_points[j]='+band_k_points[j])
 			/* Original: Coor(k) = sqrt(x^2+y^2+z^2)
 			x = band_k_points[j][0];
 			y = band_k_points[j][1];
 			z = band_k_points[j][2];
-			////window.alert('x, y, z: ' + x+y+z)
+			////window.//////alert('x, y, z: ' + x+y+z)
 			k_coor_1D[N_k_points_all] = Math.sqrt(x * x + y * y + z * z);
 			*/
-			////window.alert(k_coor_1D[j])
+			////window.//////alert(k_coor_1D[j])
 			N_k_points_all ++;
 		}//for i_k_points
 	}//for i_segments
-	////window.alert('Total number of k points in all segments: ' + N_k_points_all)
-	////window.alert('Coordinate of k points in 1D: ' + k_coor_1D)
+	////window.//////alert('Total number of k points in all segments: ' + N_k_points_all)
+	////window.//////alert('Coordinate of k points in 1D: ' + k_coor_1D)
 
 
 	var step_k_point = 1.0 / N_k_points_all; //Distance between 2 k points on the axis
@@ -137,14 +175,14 @@ function get_band_data(band_data)
 	{
 		k_coor_1D[i_k_points] = (step_k_point * i_k_points).toFixed(3);
 	}
-	//alert(k_coor_1D);
+	////////alert(k_coor_1D);
 	
 	
 	//--------Get the eigenvalues of each band trajectory--------------
 	var N_k_points_per_segment = section_k_band_segment[0].band_energies[0].length
-	////window.alert('N_k_points_per_segment: ' + N_k_points_per_segment)
+	////window.//////alert('N_k_points_per_segment: ' + N_k_points_per_segment)
 	N_bands = section_k_band_segment[0].band_energies[0][0].length; // Number of bands;
-	////window.alert('N_bands: ' + N_bands)
+	////window.//////alert('N_bands: ' + N_bands)
 	var band_energies_all = new Array(); 
 		//band_energies_all[N_band_energies_all][N_k_band_segments]: the band energy levels, combining the segments
 	for(var i_bands = 0; i_bands < N_bands; i_bands ++)
@@ -156,14 +194,14 @@ function get_band_data(band_data)
 	for(var i_segments = 0; i_segments < N_k_band_segments; i_segments ++)
 	{
 		var band_energies = section_k_band_segment[i_segments].band_energies;
-		////window.alert('band_energies:'+ band_energies)
+		////window.//////alert('band_energies:'+ band_energies)
 		var N_spin_channel = band_energies.length;
 		//if(N_spin_channel > 1) 
-			//window.alert('Number of spin channel: ' + N_spin_channel + ' is larger than 1 in band data!');//Get only the 1st spin channel !!!FIXME
+			//window.//////alert('Number of spin channel: ' + N_spin_channel + ' is larger than 1 in band data!');//Get only the 1st spin channel !!!FIXME
 
 		//for(var i_spin = 0; i_spin < N_spin_channel; i_spin ++) //Get only the 1st spin channel !!!FIXME
 		N_k_points_per_segment = band_energies[0].length; //For safety, get the number of k points in each segment again
-		////window.alert('N_k_points_per_segment: ' + N_k_points_per_segment)
+		////window.//////alert('N_k_points_per_segment: ' + N_k_points_per_segment)
 
 		for(var i_k_points = 0; i_k_points < N_k_points_per_segment; i_k_points ++)
 		{
@@ -175,46 +213,14 @@ function get_band_data(band_data)
 			N_k_points_all ++;
 		}
 		
-		////alert('band energies[band50] :' + band_energies_all[50])
+		//////////alert('band energies[band50] :' + band_energies_all[50])
 	}
-	//alert('band energies[band1] :' + band_energies_all[0])
-	//alert('N_k_points: ' + N_k_points_all + 'band_energies_all' + band_energies_all);
+	////////alert('band energies[band1] :' + band_energies_all[0])
+	////////alert('N_k_points: ' + N_k_points_all + 'band_energies_all' + band_energies_all);
 
 
 	//----------------Get the labels for x axis-----------------------------------------
 
-	function get_label_flag(array)
-	{
-		////window.alert('x, y, z:' + array);
-		if (array.toString() == [0, 0.5, 0.5].toString())
-		{
-			return "X";
-		}
-		else if (array.toString() == [0.5, 0.5, 0.5].toString())
-		{
-			return "L";
-		}
-		else if (array.toString() == [0.375, 0.375, 0.75].toString())
-		{
-			return "K";
-		}
-		else if (array.toString() == [0.25, 0.5, 0.75].toString())
-		{
-			return "W";
-		}
-		else if (array.toString() == [0, 0, 0].toString())
-		{
-			return "\u0393";
-		}
-		else if (array.toString() == [0.25, 0.625, 0.625].toString())
-		{
-			return "U";
-		}
-		else
-		{
-			return "?";
-		}
-	}
 
 	N_labels = 0; //Number of labels (including the repeated ones)
 	for(var i_segments = 0; i_segments < N_k_band_segments; i_segments ++)
@@ -264,7 +270,7 @@ function get_band_data(band_data)
 			i_labels ++;
 		}
 	}
-	//alert(label_flag);
+	////////alert(label_flag);
 	N_labels = i_labels;
 
 	//Get the coordinates for the labels
@@ -277,12 +283,11 @@ function get_band_data(band_data)
 		//y = labels_coor_0[1]
 		//z = labels_coor_0[2]
 		//label_coor_abs[i_label] = np.sqrt(x*x+y*y+z*z)
-		label_coor_relative[i_labels] = step_k_point * N_k_points_per_segment * i_labels / (1 + 1.0 / N_k_points_all);
+		label_coord_relative[i_labels] = step_k_point * N_k_points_per_segment * i_labels / (1 + 1.0 / N_k_points_all);
 	}
-	//alert(label_coor_relative);
+	////////alert(label_coor_relative);
 	
 
-	
 	//-------Get HOMO, LUMO------------------------------------
 
 	var HOMO_global = 0.0;
@@ -321,7 +326,7 @@ function get_band_data(band_data)
 					tmp_k_coord[2] = z;
 					tmp_HOMO = band_energies[0][i_k_points][i_bands] / (1.60217656535* Math.pow(10,-19));
 					tmp_occ = band_occupation_number;
-					////window.alert("HOMO (tmp): " + tmp_HOMO);
+					////window.//////alert("HOMO (tmp): " + tmp_HOMO);
 				}
 			}
 			if(tmp_HOMO > tmp_HOMO_max)
@@ -340,7 +345,7 @@ function get_band_data(band_data)
 					tmp_k_coord[2] = z;
 					tmp_LUMO = band_energies[0][i_k_points][i_bands] / (1.60217656535* Math.pow(10,-19));
 					tmp_occ = band_occupation_number;
-					////window.alert("LUMO (tmp): " + tmp_LUMO);
+					////window.//////alert("LUMO (tmp): " + tmp_LUMO);
 				}
 			}
 			if(tmp_LUMO < tmp_LUMO_min)
@@ -349,7 +354,7 @@ function get_band_data(band_data)
 				tmp_LUMO_min = tmp_LUMO;
 				coord_k_point_LUMO = tmp_k_coord;
 			}
-			////window.alert("HOMO, LUMO: " + tmp_HOMO +" | " + tmp_LUMO + "; OCC: " + tmp_occ_HOMO + "|" + tmp_occ_LUMO);
+			////window.//////alert("HOMO, LUMO: " + tmp_HOMO +" | " + tmp_LUMO + "; OCC: " + tmp_occ_HOMO + "|" + tmp_occ_LUMO);
 			N_k_points_all ++;
 		}
 	}
@@ -357,13 +362,14 @@ function get_band_data(band_data)
 	LUMO_global = tmp_LUMO_min;
 	band_gap_indirect = LUMO_global - HOMO_global;
 	E_top_valence = HOMO_global;
-	////window.alert("HOMO, N_occ, coord:" + HOMO_global + "," + tmp_occ_HOMO + "," + coord_k_point_HOMO);
-	////window.alert("LUMO, N_occ, coord:" + LUMO_global + "," + tmp_occ_LUMO + "," + coord_k_point_LUMO);
-	////window.alert("Fermi level: " + E_top_valence + ";  band gap: " + band_gap_indirect);
+	////alert(HOMO_global);
+	////window.//////alert("HOMO, N_occ, coord:" + HOMO_global + "," + tmp_occ_HOMO + "," + coord_k_point_HOMO);
+	////window.//////alert("LUMO, N_occ, coord:" + LUMO_global + "," + tmp_occ_LUMO + "," + coord_k_point_LUMO);
+	////window.//////alert("Fermi level: " + E_top_valence + ";  band gap: " + band_gap_indirect);
 	if(band_gap_indirect < 0)
 		band_gap_indirect = 0;
 
-	//window.alert("HOMO: " + HOMO_global)
+	//window.//////alert("HOMO: " + HOMO_global)
 
 	//Rescale HOMO and LUMO, and store
 	HOMO_global = (HOMO_global - E_top_valence).toFixed(3);
@@ -375,6 +381,9 @@ function get_band_data(band_data)
 	HomoLumodata["LUMO"]["energy"] = LUMO_global;
 	HomoLumodata["LUMO"]["k"] = coord_k_point_LUMO;
 	HomoLumodata["gap"] = band_gap_indirect;
+	
+	band_data_obj["homo_lumo_data"] = HomoLumodata;
+	band_data_obj["E_top_valence"] = E_top_valence;
 
 	
 	
@@ -386,8 +395,28 @@ function get_band_data(band_data)
 			band_energies_all[i_bands][i_k_points] =  band_energies_all[i_bands][i_k_points] - E_top_valence;
 		}
 	}
-	//alert(band_energies_all);
-	
+	////////alert(band_energies_all);
+
+	top_band_bottum[placeholder_band] = 100.0;
+	bottum_band_top[placeholder_band] = -1000.0;
+	//alert(view_data(top_band_bottum));
+	for(var i_k_points = 0; i_k_points < N_k_points_all; i_k_points ++)
+	{
+		for (var i_bands = 0; i_bands < N_bands; i_bands ++)
+		{
+			if(i_bands == N_bands - 1)
+			{
+				if(top_band_bottum[placeholder_band] > band_energies_all[i_bands][i_k_points])
+					top_band_bottum[placeholder_band] = band_energies_all[i_bands][i_k_points];
+			}
+			if(i_bands == 0)
+			{
+				if(bottum_band_top[placeholder_band] < band_energies_all[i_bands][i_k_points])
+					bottum_band_top[placeholder_band] = band_energies_all[i_bands][i_k_points];
+			}
+			//band_energies_all[i_bands][i_k_points] = (band_energies_all[i_bands][i_k_points] - dos_fermi_energy).toFixed(3);
+		}
+	}
 	
 	//-------------------Store the data-----------------------------
 /*	var band_data_obj = {};
@@ -408,17 +437,12 @@ function get_band_data(band_data)
 */
 
 	//============================Store the objects=================================================
+
 	
-	function pad(n, width, z) {
-		z = z || '0';
-		n = n + '';
-		return n.length >= width ? n : new Array(width - n.length + 1).join(z) + n;
-	};
-	
-	//--1-- store the band
-	var origData = {};
-	origData["bandPlotXvals"] = k_coor_1D;
-	//window.alert('k_coor: ' + origData["bandPlotXvals"])
+	//--- store the band ----
+
+	band_data_obj["bandPlotXvals"] = k_coor_1D;
+	//window.//////alert('k_coor: ' + band_data_obj["bandPlotXvals"])
 	var my_band_data = {};
 	for(var i_bands = 1; i_bands < N_bands + 1; i_bands ++)
 	{
@@ -428,14 +452,14 @@ function get_band_data(band_data)
 			name_band = "0" + name_band;
 		}
 		name_band = "Band" + name_band;
-		////window.alert('name of band: '+ name_band)
+		////window.//////alert('name of band: '+ name_band)
 		my_band_data[name_band] = band_energies_all[i_bands - 1];
 	}
-	////window.alert('my_band_data["Band0001"]: ' + my_band_data["Band0001"]);
-	origData["enSpin1"] = my_band_data
-	//window.alert('Number of points in origData["enSpin1"]["Band0001"]: ' + origData["enSpin1"]["Band0001"].length);
+	////window.//////alert('my_band_data["Band0001"]: ' + my_band_data["Band0001"]);
+	band_data_obj["enSpin1"] = my_band_data
+	//window.//////alert('Number of points in band_data_obj["enSpin1"]["Band0001"]: ' + band_data_obj["enSpin1"]["Band0001"].length);
 	
-	//--2-- store the label
+	//---- store the label ----
 	var my_label_tmp = new Array();
 	for(var i_labels = 0; i_labels < N_labels; i_labels ++)
 	{
@@ -443,9 +467,16 @@ function get_band_data(band_data)
 		my_label_tmp[i_labels][0] = label_coord_relative[i_labels];
 		my_label_tmp[i_labels][1] = label_flag[i_labels];
 	}
-	origData["labels"] = my_label_tmp;	
+	band_data_obj["labels"] = my_label_tmp;	
+	//////alert(view_data(band_data_obj["labels"]));
 	//return store_band_data(band_data_obj);
-	return origData;
+	
+	band_data_obj["program_name"] = band_data["sections"][ "section_run-0"]["program_name"];
+	band_data_obj["program_basis_set_type"] = band_data["sections"][ "section_run-0"]["program_basis_set_type"];
+	band_data_obj["atom_labels"] = band_data["sections"][ "section_run-0"]["sections"]["section_system-0"]["atom_labels"];
+	band_data_obj["XC_functional_name"] = band_data["sections"]["section_run-0"]["sections"]["section_method-0"]["section_XC_functionals"][0]["XC_functional_name"] + " + "+ band_data["sections"]["section_run-0"]["sections"]["section_method-0"]["section_XC_functionals"][1]["XC_functional_name"];
+	
+	return band_data_obj;
 }
 
 function get_dos_data(dos_data, E_top_valence)
@@ -453,9 +484,9 @@ function get_dos_data(dos_data, E_top_valence)
 	var dos_energies = {};
 	dos_energies = dos_data['sections']['section_run-0']['sections']['section_single_configuration_calculation-0']['section_dos'][0]['dos_energies'][0];
 	//N_spin_channel = DOSdata_origin['sections']['section_run-0']['sections']['section_single_configuration_calculation-0']['section_dos'][0]['dos_energies'].length; //"dos_energies"[number_of_spin_channels][number_of_dos_values]
-	////window.alert('Number of spin channels in dos: ' + N_spin_channel);
+	////window.//////alert('Number of spin channels in dos: ' + N_spin_channel);
 	//if(N_spin_channel > 1) 
-	//		window.alert('Number of spin channel: ' + N_spin_channel + ' is larger than 1.');//Get only the 1st spin channel !!!FIXME
+	//		window.//////alert('Number of spin channel: ' + N_spin_channel + ' is larger than 1.');//Get only the 1st spin channel !!!FIXME
 	var dos_values =  dos_data['sections']['section_run-0']['sections']['section_single_configuration_calculation-0']['section_dos'][0]['dos_values'][0];
 	var N_dos_values = dos_values.length;
 	var dos_fermi_energy = dos_data['sections']['section_run-0']['sections']['section_single_configuration_calculation-0']['section_dos'][0]['dos_fermi_energy']
@@ -471,34 +502,34 @@ function get_dos_data(dos_data, E_top_valence)
 	dos_data_obj["dos_energies"] = dos_energies;
 	*/
 
-	DOSdata = {};
+	var dos_data_obj = {};
 	var DOSdata_enSpin1 = {};
 	DOSdata_enSpin1["dos"] = dos_values;
 	DOSdata_enSpin1["energies"] = dos_energies;
-	DOSdata["enSpin1"] = DOSdata_enSpin1;
+	dos_data_obj["enSpin1"] = DOSdata_enSpin1;
+	
+	////////alert('dos: '+view_data(dos_data_obj));
+	
+	return dos_data_obj;
 
 }
 
-function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos)
+function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos, placeholder_overview, upperLim, lowerLim)
 {
 
 //--!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!PLOT!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
-
-	//window.alert('Begin work')
-	alert(view_data(DOSdata));	
-	//call plotBands(origData)
-	//plotBands.call(o, origData)
+	//alert('lim:'+upperLim+'  '+ lowerLim);
 	
 	var NenBands = Object.size(origData['enSpin1']);
-	////window.alert('NenBands: '+ NenBands)
+	////window.//////alert('NenBands: '+ NenBands)
 	
 	
 	/*  TEST
 	labels = origData.labels
 	Nlabels = Object.size(labels)
-	//window.alert('labels: '+ labels)
+	//window.//////alert('labels: '+ labels)
 	var inventoryJSONTextAgain = JSON.stringify(origData, null,5);
-	alert(inventoryJSONTextAgain)
+	//////alert(inventoryJSONTextAgain)
 	document.write(inventoryJSONTextAgain)
 	//origData['labels'] = [];
 	//origData['enSpin1'] = {};
@@ -527,7 +558,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 	
 	labels = origData.labels
 	Nlabels = Object.size(labels)
-	////window.alert('Before DOS: labels: '+ labels)
+	////window.//////alert('Before DOS: labels: '+ labels)
 	
 	//$.getJSON("material/"+material+"/"+method+"/dosPlotData.json", function(DOSdata){
 	bands = []
@@ -545,7 +576,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 	
 	labels = origData.labels
 	Nlabels = Object.size(labels)
-	////window.alert('labels: '+ labels)
+	//window.//////alert('labels: '+ labels)
 	
 	for (var ilabel = 0; ilabel < Nlabels; ilabel +=1) {
 	if ( labels[ilabel][1]== "Gamma" || labels[ilabel][1]== "gamma" ) { labels[ilabel][1] = "\u0393" }
@@ -566,7 +597,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 	
 	// Get the number of energy bands
 	var NenBands = Object.size(origData['enSpin1']);
-	////window.alert('NenBands: '+ NenBands)
+	////window.//////alert('NenBands: '+ NenBands)
 	
 		//var x = origData['bandPlotXvals'];
 		//for (var iband = 12; iband < 16; iband += 1) {
@@ -595,8 +626,8 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 
 	var xdos = DOSdata['enSpin1']['energies'];
 	var ydos = DOSdata['enSpin1']['dos'];
-	//window.alert("xdos: " + xdos);
-	//window.alert( "ydos: " + ydos);
+	//window.//////alert("xdos: " + xdos);
+	//window.//////alert( "ydos: " + ydos);
 	var dosLabelPos = Math.max.apply(Math, ydos)/2;
 	var d2 = [];
 	for (var i = 0; i < xdos.length; i+=1) {
@@ -662,30 +693,9 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 	var canvas_band;
 	var canvas_dos;
 
-	//console.log(origData.labels);
-	/* V01 
-	 * not needed anymore
-	function find_max(a, b)
-	{
-		if(a>b)
-			return a;
-		else
-			return b;
-	}
-	function find_min(a,b)
-	{
-		if(a>b)
-			return b;
-		else
-			return a;
-	}
-
-	var upperLim = find_max(homo,lumo) - (-10.00)
-	var lowerLim = find_min(homo,lumo) - 10.00
-	*/
 
-	//window.alert("Upper limit: " + upperLim + "lower limit: " + lowerLim);
-	//window.alert("HOMO: " + homo + "LUMO: " + lumo);
+	//window.//////alert("Upper limit: " + upperLim + "lower limit: " + lowerLim);
+	//window.//////alert("HOMO: " + homo + "LUMO: " + lumo);
 
 	var options = {  //imageClassName: "canvas-image",
 		series: {
@@ -696,7 +706,8 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 			ticks: origData.labels,
 			color:"rgb(0, 0, 0)",
 			font: {size: 20},
-			//zoomRange: [0.1, 10], panRange: [-5, 5]
+			//zoomRange: [0.1, 10], 
+			//panRange: [-10, 10]
 		},
 		yaxis: {
 			axisLabel: "Energy (eV)",
@@ -710,7 +721,8 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 			min: lowerLim,
 			max: upperLim,
 			tickDecimals: 0,
-			//zoomRange: [0.1, 10], panRange: [-5, 5]
+			//zoomRange: [0.1, 10], 
+			//panRange: [-50, 50]
 		},
 		//zoom: {
 		//	interactive: true
@@ -718,7 +730,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		//pan: {
 		//	interactive: true
 		//},
-		selection: { mode: "xy", color: "#737CDD" },
+		selection: { mode: "xy", color: "#86a6b4" },
 		
 		grid: {
 			labelMargin: 15,
@@ -734,13 +746,13 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		}
 	}
 
-	var plot_band = $.plot($(main_div_band), bands, options);
+	var plot_band = $.plot($(placeholder_band), bands, options);
 	canvas_band = plot_band.getCanvas();
-	if(main_div_band == "#placeholder")
-	{
-		bands_1 = bands;
-		dos_1 = dos;
-	}
+	//if(placeholder_band == "#placeholder")
+	//{
+	//	bands_1 = bands;
+	//	dos_1 = dos;
+	//}
 
 
 	var options_DOS ={
@@ -752,7 +764,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		yaxis: {
 			color:"rgb(0, 0, 0)",
 			font: {size: 20},
-			//ticks:[],
+			ticks:[],
 			tickLength:-5,
 			min: lowerLim,//-100.00,
 			max: upperLim,//-(-100.00),
@@ -807,8 +819,8 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 	}
 	
 
-	
-	var plot_dos = $.plot(main_div_dos, dos, options_DOS );
+
+	var plot_dos = $.plot(placeholder_dos, dos, options_DOS );
 	canvas_dos = plot_dos.getCanvas(); // save the canvas
 
 
@@ -834,7 +846,8 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 	
 	//------------Select and zoom---------------------
 	// setup overview
-	var overview = $.plot($("#overview"), bands_1, {
+	
+	var overview = $.plot(placeholder_overview, bands, {
 		legend: { show: true, container: $("#overviewLegend") },
 		series: {
 			lines: { show: true, lineWidth: 1 },
@@ -843,17 +856,17 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		xaxis: { ticks: origData.labels, axisLabelFontFamily: 'Arial'},
 		yaxis: { min: lowerLim, max: upperLim, axisLabelFontFamily: 'Arial' },
 		grid: { color: "#000" },
-		selection: { mode: "xy", color: "#737CDD" },
+		selection: { mode: "xy", color: "#86a6b4" },
 		shadowSize: 10
 	});
 	// now connect the two
 	function find_xaxis_max_min(data, lowerbound, upperbound)
 	{
 		//data[xaxis,y] find the max and min value of x axis
-		//alert("dos[0]:" + data[0]["data"]);
-		//alert("Bounds: " + lowerbound + " ,  " + upperbound)
+		////////alert("dos[0]:" + data[0]["data"]);
+		////////alert("Bounds: " + lowerbound + " ,  " + upperbound)
 		var n_data = data.length;
-		//alert("N dos: " + n_data);
+		////////alert("N dos: " + n_data);
 		var data_min = 1000000;
 		var data_max = -1000000;
 		var data_current = 0;
@@ -862,7 +875,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 			if((data[i][1] >= lowerbound) && (data[i][1] <= upperbound))
 			{
 				data_current = data[i][0];
-				//alert("data[i]: " + data[i] + "data[i][0]: " + data_current);
+				////////alert("data[i]: " + data[i] + "data[i][0]: " + data_current);
 				if(data_current >= data_max)
 				{
 					data_max = data_current;
@@ -874,20 +887,32 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 			}
 		}
 		data_max_min = [data_max, data_min];
-		//alert("data_max_min: " + data_max_min);
+		////////alert("data_max_min: " + data_max_min);
 		return data_max_min;
 	}
 	
-	$(main_div_band).bind("plotselected", function (event, ranges) {
-		//alert(view_data(ranges));
+	$(placeholder_band).bind("plotselected", function (event, ranges) {
+		
+		if(placeholder_band == "#placeholder_band")
+		{
+			bands = bands_1;
+			dos = dos_1;
+		}
+		if(placeholder_band == "#placeholder_band2")
+		{
+			bands = bands_2;
+			dos = dos_2;
+		}
+		
+		////////alert(view_data(ranges));
 		// clamp the zooming to prevent eternal zoom
 		if (ranges.xaxis.to - ranges.xaxis.from < 0.00001)
 			ranges.xaxis.to = ranges.xaxis.from + 0.00001;
 		if (ranges.yaxis.to - ranges.yaxis.from < 0.00001)
 			ranges.yaxis.to = ranges.yaxis.from + 0.00001;
 		// do the zooming
-		main_div_band = "#placeholder";
-		plot_band = $.plot($(main_div_band), bands_1,
+		//alert('placeholder:'+placeholder_band);
+		plot_band = $.plot($(placeholder_band), bands,
 					$.extend(true, {}, options, {
 						xaxis: { min: ranges.xaxis.from, max: ranges.xaxis.to },
 						yaxis: { min: ranges.yaxis.from, max: ranges.yaxis.to }
@@ -900,12 +925,10 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		//combine_imgs();
 		//image_combined = image_band;
 		var data_max_min=new Array();
-		//alert(view_data(dos));
+		////////alert(view_data(dos));
 		data_max_min = find_xaxis_max_min(dos[0]["data"], ranges.yaxis.from, ranges.yaxis.to);
 		dosLabelPos = (data_max_min[0] - data_max_min[1])/2;
-		//alert("dos label position: " + dosLabelPos);
-		main_div_dos = "#placeholder2";
-		plot_dos = $.plot(main_div_dos, dos_1, 
+		plot_dos = $.plot(placeholder_dos, dos, 
 					$.extend(true, {}, options_DOS, {
 						xaxis: { min: data_max_min[1], max: data_max_min[0],tickLength:0,tickDecimals: 0, ticks: [[ dosLabelPos ,'DOS']]},
 						yaxis: { min: ranges.yaxis.from, max: ranges.yaxis.to }
@@ -919,7 +942,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		// don't fire event on the overview to prevent eternal loop
 		overview.setSelection(ranges, true);
 	});
-	$("#overview").bind("plotselected", function (event, ranges) {
+	$(placeholder_overview).bind("plotselected", function (event, ranges) {
 		plot_band.setSelection(ranges);
 	});
 
@@ -953,11 +976,11 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		opacity: 0.90
 	}).appendTo("body");
 	
-	$(main_div_band).bind("plothover", function (event, pos, item) {
+	$(placeholder_band).bind("plothover", function (event, pos, item) {
 		//if ($("#enableTooltip:checked").length > 0) {
 			if (item)
 			{
-				if( Math.abs( item.datapoint[1]-HomoLumodata.HOMO.energy) < 0.005)
+				if( Math.abs(item.datapoint[1]-HomoLumodata.HOMO.energy) < 0.005)
 				{
 					var h = HomoLumodata.HOMO.energy.toFixed(5);
 					var x = item.datapoint[0].toFixed(2) ,
@@ -988,7 +1011,7 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		//}
 	});
 			
-	$(main_div_dos).bind("plothover", function (event, pos, item) {
+	$(placeholder_dos).bind("plothover", function (event, pos, item) {
 		//if ($("#enableTooltip:checked").length > 0) {
 		if (item) {
 			var x = item.datapoint[0].toFixed(2),
@@ -1003,7 +1026,35 @@ function plot_band_dos_flot(origData, DOSdata, placeholder_band, placeholder_dos
 		}
 
 	});
-			
+
+
+	if((placeholder_band == "#placeholder_band") && (upperLim == 10.01) &&(lowerLim == - 10.01))
+	{
+		;//alert('band 1!');
+		image_band_1 = image_band;
+		bands_1 = bands;
+		dos_1 = dos;
+		document.getElementById('atom_labels_1').innerHTML = "<b>Atom labels:</b> &nbsp&nbsp&nbsp&nbsp" + origData["atom_labels"];
+		document.getElementById('program_name_1').innerHTML = "<b>Code:</b>&nbsp&nbsp&nbsp&nbsp" + origData["program_name"];
+		document.getElementById('program_basis_set_type_1').innerHTML = "<b>Basis set type:</b>&nbsp&nbsp&nbsp&nbsp" + origData["program_basis_set_type"];
+		document.getElementById('XC_functional_name_1').innerHTML = "<b>Functional:</b>&nbsp&nbsp&nbsp&nbsp" + origData["XC_functional_name"];
+		
+	}
+	else if((placeholder_band == "#placeholder_band2") && (upperLim == 10.01) &&(lowerLim == - 10.01))
+	{
+		;//alert('band 2!');
+		image_band_2 = image_band;
+		bands_2 = bands;
+		dos_2 = dos;
+		document.getElementById('atom_labels_2').innerHTML = "<b>Atom labels:</b> &nbsp&nbsp&nbsp&nbsp" + origData["atom_labels"];
+		document.getElementById('program_name_2').innerHTML = "<b>Code:</b>&nbsp&nbsp&nbsp&nbsp" + origData["program_name"];
+		document.getElementById('program_basis_set_type_2').innerHTML = "<b>Basis set type:</b>&nbsp&nbsp&nbsp&nbsp" + origData["program_basis_set_type"];
+		document.getElementById('XC_functional_name_2').innerHTML = "<b>Functional:</b>&nbsp&nbsp&nbsp&nbsp" + origData["XC_functional_name"];
+	}
+	else 
+	{
+	}
+	
 
 	
 	//$("#description1_vis" ).html("Band structure and density of states of "+material+" in "+structure+" structure, lattice parameters optimized with "+method+", band structure calculated with "+baseMethod+'.');
diff --git a/src/tmp/6395338231213282060_band_file.json b/src/tmp/6395338231213282060_band_file.json
deleted file mode 100644
index 6526e836edd99305dcadc1a8134cf1adf85ed94c..0000000000000000000000000000000000000000
--- a/src/tmp/6395338231213282060_band_file.json
+++ /dev/null
@@ -1,1322 +0,0 @@
-{
-  "type": "nomad_info_data_json_2_0",
-  "mainFileUri": "nmd://RRTmFUP26VkFHF4wV49YLUzxMO-Ov/data/CoHf_pvV_sv/T0003.BCA/vasprun.xml.bands",
-  "parserInfo": {
-    "name":"VaspRunParser",
-    "version":"1.0",
-    "parserId":"VaspRunParser1.1.0",
-    "versionInfo":{
-      "nomadCoreVersion":{
-        "pythonCommonVersion":"1.1.0-3-g0c92f0d",
-        "name":"nomadCore",
-        "buildTime":"1473981273456",
-        "scalaVersion":"2.11.7",
-        "version":"1.3.0-15-g406258c-dirty",
-        "metaInfoVersion":"1.4.0-2-g2e3e0f0",
-        "sbtVersion":"0.13.11"
-      },
-      "name":"vasp",
-      "buildTime":"1473981274111",
-      "scalaVersion":"2.11.7",
-      "version":"1.1.0",
-      "sbtVersion":"0.13.11"
-    }
-  },
-  "sections": {
-    "section_run-0": {
-    "type": "nomad_section_1_0",
-    "gIndex": 0,
-    "name": "section_run",
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50141.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '   301'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '     10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '    -10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"],
-    "sections": {
-      "section_system-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_system-1": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 1,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_single_configuration_calculation-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_single_configuration_calculation",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "single_configuration_calculation_to_system_ref": 1,
-          "energy_free": -3.804812587017421E-18,
-          "energy_total_T0": -1.23104996076733E-21,
-          "single_configuration_to_calculation_method_ref": 0,
-          "energy_total": -3.804197061235949E-18,
-          "section_k_band": [{
-                "type": "nomad_section_1_0",
-                "name": "section_k_band",
-                "gIndex": 0,
-                "references": {
-                  "section_single_configuration_calculation": 0},
-                "section_k_band_segment": [{
-                      "type": "nomad_section_1_0",
-                      "name": "section_k_band_segment",
-                      "gIndex": 0,
-                      "references": {
-                        "section_k_band": 0},
-                      "band_segm_start_end": [[0.0, 0.0, 0.0],
-                         
-                        [
-                        0.5, 0.0, 0.5]],
-                      "band_energies": [[[-9.4604198219869E-18, -5.3020347254331E-18, -5.3020347254331E-18, -5.3020347254331E-18, -4.1588016624516005E-18, -4.1588016624516005E-18, -4.1588016624516005E-18, -3.797478811406E-19, 2.459981844162E-19, 2.459981844162E-19, 3.9179624864619996E-19, 3.9179624864619996E-19, 3.9179624864619996E-19, 6.206191006608E-19, 6.206191006608E-19, 6.206191006608E-19, 8.535915898881001E-19, 8.535915898881001E-19, 1.0906656510322E-18, 1.0906656510322E-18, 1.0906656510322E-18, 1.4943340277657E-18, 1.4943340277657E-18, 2.0772378929103E-18, 2.0772378929103E-18, 2.0772378929103E-18, 2.2719504066012E-18, 2.5636586874183002E-18, 2.6076864984627E-18, 2.8315586249996E-18, 2.8315586249996E-18, 2.8315586249996E-18, 3.0985773654894E-18, 3.0985773654894E-18, 3.0985773654894E-18, 3.8776837684978E-18, 3.8776837684978E-18, 4.1637523879293E-18, 4.3114410204647005E-18, 4.3114410204647005E-18, 4.3114410204647005E-18, 5.4904026200652E-18, 5.4904026200652E-18, 5.9242880461545E-18, 5.9242880461545E-18, 5.9242880461545E-18, 6.2115743197487994E-18, 6.2115743197487994E-18, 6.2115743197487994E-18, 6.430495720808E-18, 6.430495720808E-18, 6.430495720808E-18, 6.489167425336601E-18, 6.508137195451801E-18, 6.508137195451801E-18, 6.508137195451801E-18, 6.580523531077201E-18, 6.580523531077201E-18, 6.580523531077201E-18, 7.023733624571101E-18, 7.023733624571101E-18, 7.023733624571101E-18, 7.103409863408E-18, 7.711756291849001E-18, 7.711756291849001E-18, 7.905187064315901E-18, 7.905187064315901E-18, 7.9053793254995E-18],
-                          [-9.4604198219869E-18, -5.3020507471984E-18, -5.3020507471984E-18, -5.3020187036678E-18, -4.1588657495128E-18, -4.158769618921E-18, -4.158769618921E-18, -3.771843986926E-19, 2.467512073853E-19, 2.469274468036E-19, 3.9093107332000003E-19, 3.9222883630930004E-19, 3.9222883630930004E-19, 6.172705517131E-19, 6.218367548236001E-19, 6.218367548236001E-19, 8.534473940004001E-19, 8.549053746427E-19, 1.0862917091053E-18, 1.0884866909514E-18, 1.0884866909514E-18, 1.4930042212458E-18, 1.493068308307E-18, 2.0756196946150002E-18, 2.0787118953179E-18, 2.0787118953179E-18, 2.2794646145269E-18, 2.5656133427849004E-18, 2.6127333545322004E-18, 2.8144473796592005E-18, 2.8144473796592005E-18, 2.8194782139634E-18, 3.1000193243664E-18, 3.1175791791352E-18, 3.1175791791352E-18, 3.868551362276801E-18, 3.8850057152399E-18, 4.1735416865276E-18, 4.3160072235752E-18, 4.3160232453405004E-18, 4.3171127253809E-18, 5.4519984486411005E-18, 5.4977726321032E-18, 5.9053182760393005E-18, 5.9053182760393005E-18, 5.9544249866838005E-18, 6.1856511034933995E-18, 6.1856511034933995E-18, 6.205261744220601E-18, 6.3882303039466E-18, 6.3882303039466E-18, 6.4345652491942E-18, 6.4758853819029E-18, 6.4816532174109E-18, 6.4816532174109E-18, 6.5241108954559E-18, 6.5811323581586E-18, 6.6881897938932E-18, 6.6881897938932E-18, 7.0101311458314E-18, 7.0368714721171E-18, 7.0368714721171E-18, 7.106486042345601E-18, 7.7151689278579E-18, 7.7163064731942E-18, 7.8849035094461E-18, 7.884999640037901E-18, 7.908759917977801E-18],
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-                "XC_functional_name": "GGA_X_PBE"
-              },{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 1,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_C_PBE"
-              }]
-        }},
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50141.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '   301'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '     10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '    -10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"]
-  }},
-  "parserStatus": "ParseSuccess"
-}
\ No newline at end of file
diff --git a/src/tmp/6395338231213282060_dos_file.json b/src/tmp/6395338231213282060_dos_file.json
deleted file mode 100644
index c792215c96c6f1971ba60272a836601865b182ee..0000000000000000000000000000000000000000
--- a/src/tmp/6395338231213282060_dos_file.json
+++ /dev/null
@@ -1,15751 +0,0 @@
-{
-  "type": "nomad_info_data_json_2_0",
-  "mainFileUri": "nmd://RRTmFUP26VkFHF4wV49YLUzxMO-Ov/data/CoHf_pvV_sv/T0003.BCA/vasprun.xml.static",
-  "parserInfo": {
-    "name":"VaspRunParser",
-    "version":"1.0",
-    "parserId":"VaspRunParser1.1.0-dirty",
-    "versionInfo":{
-      "nomadCoreVersion":{
-        "pythonCommonVersion":"1.2.0",
-        "name":"nomadCore",
-        "buildTime":"1475297566899",
-        "scalaVersion":"2.11.7",
-        "version":"1.4.0-1-g39941b7-dirty",
-        "metaInfoVersion":"1.5.0-7-ga9cce07",
-        "sbtVersion":"0.13.11"
-      },
-      "name":"vasp",
-      "buildTime":"1475297565742",
-      "scalaVersion":"2.11.7",
-      "version":"1.1.0-dirty",
-      "sbtVersion":"0.13.11"
-    }
-  },
-  "sections": {
-    "section_run-0": {
-    "type": "nomad_section_1_0",
-    "gIndex": 0,
-    "name": "section_run",
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50027.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown array tetrahedronlist in kpoints","Unknown tag i in kpoints","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"],
-    "sections": {
-      "section_system-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_system-1": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 1,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_single_configuration_calculation-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_single_configuration_calculation",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "single_configuration_calculation_to_system_ref": 1,
-          "energy_free": -3.865569453804049E-18,
-          "energy_total_T0": 0.0,
-          "single_configuration_to_calculation_method_ref": 0,
-          "energy_total": -3.865569453804049E-18,
-          "section_eigenvalues": [{
-                "type": "nomad_section_1_0",
-                "name": "section_eigenvalues",
-                "gIndex": 0,
-                "references": {
-                  "section_single_configuration_calculation": 0},
-                "eigenvalues_values": [[[-9.4603397131604E-18, -5.3019866601371995E-18, -5.3019706383719E-18, -5.3019706383719E-18, -4.1588016624516005E-18, -4.1588016624516005E-18, -4.1588016624516005E-18, -3.797478811406E-19, 2.4598216265090003E-19, 2.4598216265090003E-19, 3.91732161585E-19, 3.91732161585E-19, 3.91732161585E-19, 6.211798624463E-19, 6.211798624463E-19, 6.211798624463E-19, 8.530949151638001E-19, 8.530949151638001E-19, 1.0905374769098E-18, 1.0905374769098E-18, 1.0905374769098E-18, 1.4939495053985002E-18, 1.4939495053985002E-18, 2.0776224152775E-18, 2.0776224152775E-18, 2.0776224152775E-18, 2.2719504066012E-18, 2.5636586874183002E-18, 2.6076864984627E-18, 2.831847016775E-18, 2.831847016775E-18, 2.831847016775E-18, 3.0982409084181005E-18, 3.0982409084181005E-18, 3.0982409084181005E-18, 3.8774754855489E-18, 3.8774754855489E-18, 4.1637523879293E-18, 4.3114410204647005E-18, 4.3114410204647005E-18, 4.3114410204647005E-18, 5.4904667071264E-18, 5.4904667071264E-18, 5.924256002623901E-18, 5.924256002623901E-18, 5.924256002623901E-18, 6.2117826026976994E-18, 6.2117826026976994E-18, 6.2117826026976994E-18, 6.430495720808E-18, 6.430495720808E-18, 6.430495720808E-18, 6.489167425336601E-18, 6.5082173042783E-18, 6.5082173042783E-18, 6.5082173042783E-18, 6.580523531077201E-18, 6.580523531077201E-18, 6.580523531077201E-18, 7.023861798693501E-18, 7.023861798693501E-18, 7.023861798693501E-18, 7.103409863408E-18, 7.7112115518288E-18, 7.7112115518288E-18, 7.9051550207853E-18, 7.9051550207853E-18, 7.9051550207853E-18],
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-                "type": "nomad_section_1_0",
-                "name": "section_eigenvalues",
-                "gIndex": 1,
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-                  "section_single_configuration_calculation": 0},
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-          "x_vasp_incarOut_ISTART": 0,
-          "x_vasp_incarOut_IBRION": -1,
-          "x_vasp_incarOut_NSW": 0,
-          "x_vasp_incar_ISIF": 2,
-          "x_vasp_incarOut_ISYM": 2,
-          "x_vasp_incar_LWAVE": 0,
-          "x_vasp_incarOut_GGA": "--",
-          "x_vasp_incarOut_NELM": [120],
-          "x_vasp_incarOut_IALGO": 38,
-          "x_vasp_incar_ISPIN": 1,
-          "x_vasp_incarOut_ISPIN": 1,
-          "x_vasp_incarOut_LSCALU": 0,
-          "x_vasp_incar_NSIM": 4,
-          "x_vasp_incar_LELF": 1,
-          "x_vasp_incarOut_NELMDL": 0,
-          "x_vasp_incar_LORBIT": "F",
-          "x_vasp_incarOut_ISMEAR": -5,
-          "x_vasp_incar_SYSTEM": "CoHf_pvV_sv.T0003.BCA",
-          "x_vasp_incarOut_ICHARG": 2,
-          "x_vasp_incarOut_ISIF": 2,
-          "x_vasp_incarOut_NGXF": 42,
-          "x_vasp_incarOut_NBANDS": 66,
-          "x_vasp_incar_NELMIN": 2,
-          "x_vasp_incarOut_NBLOCK": 1,
-          "x_vasp_incarOut_LELF": 1,
-          "x_vasp_incarOut_NSIM": 4,
-          "x_vasp_incarOut_LWAVE": 0,
-          "x_vasp_incar_PREC": "high",
-          "x_vasp_incar_ALGO": "Normal",
-          "x_vasp_incarOut_LPLANE": 1,
-          "x_vasp_incarOut_NGZ": 28,
-          "x_vasp_incarOut_LASYNC": 0,
-          "x_vasp_incarOut_PREC": "high",
-          "x_vasp_incarOut_INIWAV": 1,
-          "x_vasp_incarOut_LSCALAPACK": 0,
-          "x_vasp_incarOut_LORBIT": "F",
-          "x_vasp_incar_LCHARG": 1,
-          "electronic_structure_method": "DFT",
-          "x_vasp_incarOut_NELMIN": 2,
-          "x_vasp_incarOut_NGZF": 42,
-          "x_vasp_incarOut_NWRITE": 2,
-          "x_vasp_incarOut_LDAU": 0,
-          "x_vasp_incarOut_NPAR": 4,
-          "x_vasp_incar_LREAL": "F",
-          "x_vasp_incar_IBRION": 2,
-          "section_XC_functionals": [{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 0,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_X_PBE"
-              },{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 1,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_C_PBE"
-              }]
-        }},
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50027.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown array tetrahedronlist in kpoints","Unknown tag i in kpoints","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"]
-  }},
-  "parserStatus": "ParseSuccess"
-}
\ No newline at end of file
diff --git a/src/tmp/8827707185690202207_band_file.json b/src/tmp/8827707185690202207_band_file.json
deleted file mode 100644
index 6526e836edd99305dcadc1a8134cf1adf85ed94c..0000000000000000000000000000000000000000
--- a/src/tmp/8827707185690202207_band_file.json
+++ /dev/null
@@ -1,1322 +0,0 @@
-{
-  "type": "nomad_info_data_json_2_0",
-  "mainFileUri": "nmd://RRTmFUP26VkFHF4wV49YLUzxMO-Ov/data/CoHf_pvV_sv/T0003.BCA/vasprun.xml.bands",
-  "parserInfo": {
-    "name":"VaspRunParser",
-    "version":"1.0",
-    "parserId":"VaspRunParser1.1.0",
-    "versionInfo":{
-      "nomadCoreVersion":{
-        "pythonCommonVersion":"1.1.0-3-g0c92f0d",
-        "name":"nomadCore",
-        "buildTime":"1473981273456",
-        "scalaVersion":"2.11.7",
-        "version":"1.3.0-15-g406258c-dirty",
-        "metaInfoVersion":"1.4.0-2-g2e3e0f0",
-        "sbtVersion":"0.13.11"
-      },
-      "name":"vasp",
-      "buildTime":"1473981274111",
-      "scalaVersion":"2.11.7",
-      "version":"1.1.0",
-      "sbtVersion":"0.13.11"
-    }
-  },
-  "sections": {
-    "section_run-0": {
-    "type": "nomad_section_1_0",
-    "gIndex": 0,
-    "name": "section_run",
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50141.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '   301'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '     10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '    -10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"],
-    "sections": {
-      "section_system-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_system-1": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 1,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_single_configuration_calculation-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_single_configuration_calculation",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "single_configuration_calculation_to_system_ref": 1,
-          "energy_free": -3.804812587017421E-18,
-          "energy_total_T0": -1.23104996076733E-21,
-          "single_configuration_to_calculation_method_ref": 0,
-          "energy_total": -3.804197061235949E-18,
-          "section_k_band": [{
-                "type": "nomad_section_1_0",
-                "name": "section_k_band",
-                "gIndex": 0,
-                "references": {
-                  "section_single_configuration_calculation": 0},
-                "section_k_band_segment": [{
-                      "type": "nomad_section_1_0",
-                      "name": "section_k_band_segment",
-                      "gIndex": 0,
-                      "references": {
-                        "section_k_band": 0},
-                      "band_segm_start_end": [[0.0, 0.0, 0.0],
-                         
-                        [
-                        0.5, 0.0, 0.5]],
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-                          [1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 0.9482, 0.229, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0],
-                          [1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 0.8221, 0.3272, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0],
-                          [1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 0.6525, 0.4091, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0],
-                          [1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 0.5253, 0.4624, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0],
-                          [1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 0.4809, 0.4809, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]]
-                    }]
-              }]
-        },
-      "section_system-2": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 2,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_sampling_method-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_sampling_method",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "sampling_method": "geometry_optimization"
-        },
-      "section_frame_sequence-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_frame_sequence",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "frame_sequence_to_sampling_ref": 0,
-          "frame_sequence_local_frames_ref": [0]
-        },
-      "section_method-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_method",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "x_vasp_incarOut_NGY": 28,
-          "x_vasp_incarOut_KBLOCK": 1,
-          "x_vasp_incarOut_LCORR": 1,
-          "x_vasp_incarOut_NBLK": 96,
-          "x_vasp_incarOut_SYSTEM": "CoHf_pvV_sv.T0003.BCA",
-          "x_vasp_incarOut_LREAL": "F",
-          "x_vasp_incarOut_VOSKOWN": 0,
-          "x_vasp_incarOut_LCHARG": 0,
-          "x_vasp_incar_LSCALU": 0,
-          "x_vasp_incar_ISYM": 2,
-          "x_vasp_k_points_generation_method": "listgenerated",
-          "x_vasp_incar_ISMEAR": 0,
-          "x_vasp_incar_NSW": 0,
-          "x_vasp_incar_NELM": [120],
-          "x_vasp_incarOut_LVTOT": 0,
-          "x_vasp_incarOut_NPACO": 256,
-          "x_vasp_incarOut_NGYF": 42,
-          "x_vasp_incarOut_NGX": 28,
-          "x_vasp_incar_NBANDS": 66,
-          "x_vasp_incar_ICHARG": 11,
-          "x_vasp_incar_LPLANE": 1,
-          "x_vasp_incarOut_IWAVPR": 10,
-          "x_vasp_incarOut_ISTART": 0,
-          "x_vasp_incarOut_IBRION": -1,
-          "x_vasp_incarOut_NSW": 0,
-          "x_vasp_incar_ISIF": 2,
-          "x_vasp_incarOut_ISYM": 2,
-          "x_vasp_incar_LWAVE": 0,
-          "x_vasp_incarOut_GGA": "--",
-          "x_vasp_incarOut_NELM": [120],
-          "x_vasp_incarOut_IALGO": 38,
-          "x_vasp_incar_ISPIN": 1,
-          "x_vasp_incarOut_ISPIN": 1,
-          "x_vasp_incarOut_LSCALU": 0,
-          "x_vasp_incar_NSIM": 4,
-          "x_vasp_incarOut_NELMDL": 0,
-          "x_vasp_incarOut_ISMEAR": 0,
-          "x_vasp_incar_SYSTEM": "CoHf_pvV_sv.T0003.BCA",
-          "x_vasp_incarOut_ICHARG": 11,
-          "x_vasp_incarOut_ISIF": 2,
-          "x_vasp_incarOut_NGXF": 42,
-          "x_vasp_incarOut_NBANDS": 66,
-          "x_vasp_incar_NELMIN": 2,
-          "x_vasp_incarOut_NBLOCK": 1,
-          "x_vasp_incarOut_LELF": 0,
-          "x_vasp_incarOut_NSIM": 4,
-          "x_vasp_incarOut_LWAVE": 0,
-          "x_vasp_incar_PREC": "high",
-          "x_vasp_incar_ALGO": "Normal",
-          "x_vasp_incarOut_LPLANE": 1,
-          "x_vasp_incarOut_NGZ": 28,
-          "x_vasp_incarOut_LASYNC": 0,
-          "x_vasp_incarOut_PREC": "high",
-          "x_vasp_incarOut_INIWAV": 1,
-          "x_vasp_incarOut_LSCALAPACK": 0,
-          "x_vasp_incarOut_LORBIT": "F",
-          "x_vasp_incar_LCHARG": 0,
-          "electronic_structure_method": "DFT",
-          "x_vasp_incarOut_NELMIN": 2,
-          "x_vasp_incarOut_NGZF": 42,
-          "x_vasp_incarOut_NWRITE": 2,
-          "x_vasp_incarOut_LDAU": 0,
-          "x_vasp_incarOut_NPAR": 4,
-          "x_vasp_incar_LREAL": "F",
-          "x_vasp_incar_IBRION": 2,
-          "section_XC_functionals": [{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 0,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_X_PBE"
-              },{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 1,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_C_PBE"
-              }]
-        }},
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50141.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '   301'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '     10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '    -10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"]
-  }},
-  "parserStatus": "ParseSuccess"
-}
\ No newline at end of file
diff --git a/src/tmp/8827707185690202207_band_file2.json b/src/tmp/8827707185690202207_band_file2.json
deleted file mode 100644
index 4a42ab2b1de6700dcd3ecc962053d0c71c64e4f6..0000000000000000000000000000000000000000
--- a/src/tmp/8827707185690202207_band_file2.json
+++ /dev/null
@@ -1,1322 +0,0 @@
-{
-  "type": "nomad_info_data_json_2_0",
-  "mainFileUri": "nmd://RRTmFUP26VkFHF4wV49YLUzxMO-Ov/data/Be_svPRh_pv/T0003.ABC/vasprun.xml.bands",
-  "parserInfo": {
-    "name":"VaspRunParser",
-    "version":"1.0",
-    "parserId":"VaspRunParser1.1.0",
-    "versionInfo":{
-      "nomadCoreVersion":{
-        "pythonCommonVersion":"1.1.0-3-g0c92f0d",
-        "name":"nomadCore",
-        "buildTime":"1473981273456",
-        "scalaVersion":"2.11.7",
-        "version":"1.3.0-15-g406258c-dirty",
-        "metaInfoVersion":"1.4.0-2-g2e3e0f0",
-        "sbtVersion":"0.13.11"
-      },
-      "name":"vasp",
-      "buildTime":"1473981274111",
-      "scalaVersion":"2.11.7",
-      "version":"1.1.0",
-      "sbtVersion":"0.13.11"
-    }
-  },
-  "sections": {
-    "section_run-0": {
-    "type": "nomad_section_1_0",
-    "gIndex": 0,
-    "name": "section_run",
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 16500.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    531.92600000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    432.25000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '   301'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '     10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '    -10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"],
-    "sections": {
-      "section_system-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[2.69998791E-10, 2.69998791E-10, 2.69998791E-10],
-             
-            [
-            1.349993955E-10, 1.349993955E-10, 1.349993955E-10],
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-          "references": {
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-          "atom_labels": ["Be", "P", "Rh"]
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-          "references": {
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-          "references": {
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-          "frame_sequence_local_frames_ref": [0]
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-          "name": "section_method",
-          "gIndex": 0,
-          "references": {
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-          "x_vasp_incarOut_NGY": 28,
-          "x_vasp_incarOut_KBLOCK": 1,
-          "x_vasp_incarOut_LCORR": 1,
-          "x_vasp_incarOut_NBLK": 64,
-          "x_vasp_incarOut_SYSTEM": "Be_svPRh_pv.T0003.ABC",
-          "x_vasp_incarOut_LREAL": "F",
-          "x_vasp_incarOut_VOSKOWN": 0,
-          "x_vasp_incarOut_LCHARG": 0,
-          "x_vasp_incar_LSCALU": 0,
-          "x_vasp_incar_ISYM": 2,
-          "x_vasp_k_points_generation_method": "listgenerated",
-          "x_vasp_incar_ISMEAR": 0,
-          "x_vasp_incar_NSW": 0,
-          "x_vasp_incar_NELM": [120],
-          "x_vasp_incarOut_LVTOT": 0,
-          "x_vasp_incarOut_NPACO": 256,
-          "x_vasp_incarOut_NGYF": 40,
-          "x_vasp_incarOut_NGX": 28,
-          "x_vasp_incar_NBANDS": 59,
-          "x_vasp_incar_ICHARG": 11,
-          "x_vasp_incar_LPLANE": 1,
-          "x_vasp_incarOut_IWAVPR": 10,
-          "x_vasp_incarOut_ISTART": 0,
-          "x_vasp_incarOut_IBRION": -1,
-          "x_vasp_incarOut_NSW": 0,
-          "x_vasp_incar_ISIF": 2,
-          "x_vasp_incarOut_ISYM": 2,
-          "x_vasp_incar_LWAVE": 0,
-          "x_vasp_incarOut_GGA": "--",
-          "x_vasp_incarOut_NELM": [120],
-          "x_vasp_incarOut_IALGO": 38,
-          "x_vasp_incar_ISPIN": 1,
-          "x_vasp_incarOut_ISPIN": 1,
-          "x_vasp_incarOut_LSCALU": 0,
-          "x_vasp_incar_NSIM": 4,
-          "x_vasp_incarOut_NELMDL": 0,
-          "x_vasp_incarOut_ISMEAR": 0,
-          "x_vasp_incar_SYSTEM": "Be_svPRh_pv.T0003.ABC",
-          "x_vasp_incarOut_ICHARG": 11,
-          "x_vasp_incarOut_ISIF": 2,
-          "x_vasp_incarOut_NGXF": 40,
-          "x_vasp_incarOut_NBANDS": 59,
-          "x_vasp_incar_NELMIN": 2,
-          "x_vasp_incarOut_NBLOCK": 1,
-          "x_vasp_incarOut_LELF": 0,
-          "x_vasp_incarOut_NSIM": 4,
-          "x_vasp_incarOut_LWAVE": 0,
-          "x_vasp_incar_PREC": "high",
-          "x_vasp_incar_ALGO": "Normal",
-          "x_vasp_incarOut_LPLANE": 1,
-          "x_vasp_incarOut_NGZ": 28,
-          "x_vasp_incarOut_LASYNC": 0,
-          "x_vasp_incarOut_PREC": "high",
-          "x_vasp_incarOut_INIWAV": 1,
-          "x_vasp_incarOut_LSCALAPACK": 0,
-          "x_vasp_incarOut_LORBIT": "F",
-          "x_vasp_incar_LCHARG": 0,
-          "electronic_structure_method": "DFT",
-          "x_vasp_incarOut_NELMIN": 2,
-          "x_vasp_incarOut_NGZF": 40,
-          "x_vasp_incarOut_NWRITE": 2,
-          "x_vasp_incarOut_LDAU": 0,
-          "x_vasp_incarOut_NPAR": 4,
-          "x_vasp_incar_LREAL": "F",
-          "x_vasp_incar_IBRION": 2,
-          "section_XC_functionals": [{
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-                "name": "section_XC_functionals",
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-                "references": {
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-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 16500.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    531.92600000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    432.25000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '   301'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '     10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '    -10.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"]
-  }},
-  "parserStatus": "ParseSuccess"
-}
\ No newline at end of file
diff --git a/src/tmp/8827707185690202207_dos_file.json b/src/tmp/8827707185690202207_dos_file.json
deleted file mode 100644
index c792215c96c6f1971ba60272a836601865b182ee..0000000000000000000000000000000000000000
--- a/src/tmp/8827707185690202207_dos_file.json
+++ /dev/null
@@ -1,15751 +0,0 @@
-{
-  "type": "nomad_info_data_json_2_0",
-  "mainFileUri": "nmd://RRTmFUP26VkFHF4wV49YLUzxMO-Ov/data/CoHf_pvV_sv/T0003.BCA/vasprun.xml.static",
-  "parserInfo": {
-    "name":"VaspRunParser",
-    "version":"1.0",
-    "parserId":"VaspRunParser1.1.0-dirty",
-    "versionInfo":{
-      "nomadCoreVersion":{
-        "pythonCommonVersion":"1.2.0",
-        "name":"nomadCore",
-        "buildTime":"1475297566899",
-        "scalaVersion":"2.11.7",
-        "version":"1.4.0-1-g39941b7-dirty",
-        "metaInfoVersion":"1.5.0-7-ga9cce07",
-        "sbtVersion":"0.13.11"
-      },
-      "name":"vasp",
-      "buildTime":"1475297565742",
-      "scalaVersion":"2.11.7",
-      "version":"1.1.0-dirty",
-      "sbtVersion":"0.13.11"
-    }
-  },
-  "sections": {
-    "section_run-0": {
-    "type": "nomad_section_1_0",
-    "gIndex": 0,
-    "name": "section_run",
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50027.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown array tetrahedronlist in kpoints","Unknown tag i in kpoints","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"],
-    "sections": {
-      "section_system-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_system-1": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 1,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_single_configuration_calculation-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_single_configuration_calculation",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "single_configuration_calculation_to_system_ref": 1,
-          "energy_free": -3.865569453804049E-18,
-          "energy_total_T0": 0.0,
-          "single_configuration_to_calculation_method_ref": 0,
-          "energy_total": -3.865569453804049E-18,
-          "section_eigenvalues": [{
-                "type": "nomad_section_1_0",
-                "name": "section_eigenvalues",
-                "gIndex": 0,
-                "references": {
-                  "section_single_configuration_calculation": 0},
-                "eigenvalues_values": [[[-9.4603397131604E-18, -5.3019866601371995E-18, -5.3019706383719E-18, -5.3019706383719E-18, -4.1588016624516005E-18, -4.1588016624516005E-18, -4.1588016624516005E-18, -3.797478811406E-19, 2.4598216265090003E-19, 2.4598216265090003E-19, 3.91732161585E-19, 3.91732161585E-19, 3.91732161585E-19, 6.211798624463E-19, 6.211798624463E-19, 6.211798624463E-19, 8.530949151638001E-19, 8.530949151638001E-19, 1.0905374769098E-18, 1.0905374769098E-18, 1.0905374769098E-18, 1.4939495053985002E-18, 1.4939495053985002E-18, 2.0776224152775E-18, 2.0776224152775E-18, 2.0776224152775E-18, 2.2719504066012E-18, 2.5636586874183002E-18, 2.6076864984627E-18, 2.831847016775E-18, 2.831847016775E-18, 2.831847016775E-18, 3.0982409084181005E-18, 3.0982409084181005E-18, 3.0982409084181005E-18, 3.8774754855489E-18, 3.8774754855489E-18, 4.1637523879293E-18, 4.3114410204647005E-18, 4.3114410204647005E-18, 4.3114410204647005E-18, 5.4904667071264E-18, 5.4904667071264E-18, 5.924256002623901E-18, 5.924256002623901E-18, 5.924256002623901E-18, 6.2117826026976994E-18, 6.2117826026976994E-18, 6.2117826026976994E-18, 6.430495720808E-18, 6.430495720808E-18, 6.430495720808E-18, 6.489167425336601E-18, 6.5082173042783E-18, 6.5082173042783E-18, 6.5082173042783E-18, 6.580523531077201E-18, 6.580523531077201E-18, 6.580523531077201E-18, 7.023861798693501E-18, 7.023861798693501E-18, 7.023861798693501E-18, 7.103409863408E-18, 7.7112115518288E-18, 7.7112115518288E-18, 7.9051550207853E-18, 7.9051550207853E-18, 7.9051550207853E-18],
-                    [-9.4603397131604E-18, -5.3020187036678E-18, -5.3020187036678E-18, -5.301938594841301E-18, -4.1590580106964E-18, -4.1587535971557E-18, -4.1587535971557E-18, -3.6749123068609997E-19, 2.50099756333E-19, 2.50099756333E-19, 3.8729413259690003E-19, 3.940232740229E-19, 3.940232740229E-19, 6.174467911314001E-19, 6.174467911314001E-19, 6.241118454962E-19, 8.556423758465E-19, 8.556423758465E-19, 1.0636689765017E-18, 1.083551987239E-18, 1.083551987239E-18, 1.4881015610640002E-18, 1.4881015610640002E-18, 2.0461877117589E-18, 2.0987070584123E-18, 2.0987070584123E-18, 2.3005973229576E-18, 2.570051371773E-18, 2.6333213229427E-18, 2.7383279727189E-18, 2.7889247075363E-18, 2.7889247075363E-18, 3.1218569904703E-18, 3.1218569904703E-18, 3.2002514880832E-18, 3.8747838289785E-18, 3.8747838289785E-18, 4.2097989414015E-18, 4.3195640554718E-18, 4.3407928944943E-18, 4.3407928944943E-18, 5.4226786181421004E-18, 5.4226786181421004E-18, 5.7880870193391996E-18, 5.9660087229957E-18, 5.9660087229957E-18, 6.1569240783105E-18, 6.1569240783105E-18, 6.179498745618201E-18, 6.230383872211E-18, 6.2821181523647E-18, 6.2821181523647E-18, 6.4660800615393E-18, 6.5413503149187E-18, 6.5413503149187E-18, 6.5863394318811E-18, 6.790472743568401E-18, 6.7904887653337E-18, 6.8002139768708004E-18, 7.0439210488491E-18, 7.0439210488491E-18, 7.0503617984997E-18, 7.1190951716367E-18, 7.718100910907801E-18, 7.718100910907801E-18, 7.813093957371501E-18, 7.8998037511751E-18, 7.899819772940401E-18],
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-                     [0.0352, 0.135, 0.2605],
-                     [0.0359, 0.1358, 0.263],
-                     [0.0365, 0.1361, 0.2652],
-                     [0.0371, 0.1357, 0.2665],
-                     [0.0376, 0.135, 0.2674],
-                     [0.0368, 0.1331, 0.2659],
-                     [0.0329, 0.1304, 0.2638],
-                     [0.0322, 0.1291, 0.2632],
-                     [0.0315, 0.1279, 0.2627],
-                     [0.031, 0.1272, 0.2626],
-                     [0.0304, 0.126, 0.2617],
-                     [0.0299, 0.1244, 0.2599],
-                     [0.0293, 0.1227, 0.2575],
-                     [0.0288, 0.121, 0.2547],
-                     [0.0284, 0.1195, 0.2525],
-                     [0.0281, 0.1188, 0.2521],
-                     [0.0279, 0.1185, 0.2527],
-                     [0.0277, 0.1183, 0.2534],
-                     [0.0273, 0.1171, 0.2494],
-                     [0.0268, 0.1154, 0.2432],
-                     [0.026, 0.1137, 0.2391],
-                     [0.0252, 0.1113, 0.2317],
-                     [0.0245, 0.1091, 0.2246],
-                     [0.0241, 0.1063, 0.2163],
-                     [0.024, 0.1044, 0.2106],
-                     [0.0237, 0.1022, 0.2049],
-                     [0.0232, 0.0998, 0.1988],
-                     [0.0225, 0.0967, 0.1904],
-                     [0.0217, 0.094, 0.1833],
-                     [0.021, 0.0913, 0.1771],
-                     [0.0204, 0.0886, 0.1722],
-                     [0.0199, 0.0857, 0.1684],
-                     [0.0195, 0.0836, 0.167],
-                     [0.0193, 0.0828, 0.1683],
-                     [0.0191, 0.0824, 0.1706],
-                     [0.019, 0.082, 0.1729],
-                     [0.0191, 0.0828, 0.177],
-                     [0.0194, 0.084, 0.1818],
-                     [0.0198, 0.0856, 0.1872],
-                     [0.0211, 0.0904, 0.2034],
-                     [0.0216, 0.0921, 0.2076],
-                     [0.022, 0.0938, 0.2114],
-                     [0.0224, 0.0954, 0.2151],
-                     [0.0228, 0.0971, 0.2186],
-                     [0.0233, 0.0987, 0.222],
-                     [0.0239, 0.1, 0.2248],
-                     [0.0245, 0.1013, 0.2272],
-                     [0.0252, 0.1026, 0.2293],
-                     [0.026, 0.104, 0.2313],
-                     [0.0269, 0.1055, 0.233],
-                     [0.0279, 0.1052, 0.23],
-                     [0.029, 0.1068, 0.2289],
-                     [0.0304, 0.1091, 0.2292],
-                     [0.032, 0.1122, 0.2313],
-                     [0.0334, 0.1151, 0.2344],
-                     [0.0346, 0.1174, 0.2371],
-                     [0.0357, 0.1191, 0.239],
-                     [0.0366, 0.12, 0.2399],
-                     [0.0375, 0.1208, 0.2406],
-                     [0.0386, 0.1223, 0.2425],
-                     [0.0429, 0.1297, 0.257],
-                     [0.0439, 0.1313, 0.2586],
-                     [0.0439, 0.1285, 0.2557],
-                     [0.0437, 0.1258, 0.2528],
-                     [0.0442, 0.1243, 0.2516],
-                     [0.0448, 0.1232, 0.2511],
-                     [0.0458, 0.1225, 0.2516],
-                     [0.0467, 0.122, 0.2522],
-                     [0.0478, 0.122, 0.2537],
-                     [0.0483, 0.1222, 0.2566],
-                     [0.0479, 0.1215, 0.2548],
-                     [0.0475, 0.1243, 0.2539],
-                     [0.0468, 0.1219, 0.251],
-                     [0.0461, 0.1167, 0.2477],
-                     [0.0456, 0.1154, 0.2463],
-                     [0.0449, 0.1143, 0.245],
-                     [0.0442, 0.1131, 0.2436],
-                     [0.044, 0.1122, 0.2426],
-                     [0.044, 0.1114, 0.242],
-                     [0.0441, 0.111, 0.2421],
-                     [0.0445, 0.1112, 0.243],
-                     [0.0452, 0.1119, 0.245],
-                     [0.0461, 0.1131, 0.2476],
-                     [0.0471, 0.1142, 0.2504],
-                     [0.046, 0.1138, 0.2503],
-                     [0.045, 0.1131, 0.2492],
-                     [0.0448, 0.1127, 0.2486],
-                     [0.0447, 0.1125, 0.2483],
-                     [0.0446, 0.1125, 0.2486],
-                     [0.0445, 0.1126, 0.2495],
-                     [0.0445, 0.1128, 0.2507],
-                     [0.0446, 0.1132, 0.2524],
-                     [0.0447, 0.1137, 0.2545],
-                     [0.045, 0.1171, 0.2601],
-                     [0.0452, 0.1169, 0.2623],
-                     [0.0455, 0.1142, 0.2623],
-                     [0.045, 0.1139, 0.2611],
-                     [0.0447, 0.1134, 0.2594],
-                     [0.0453, 0.1145, 0.2642],
-                     [0.0456, 0.1149, 0.2675],
-                     [0.0459, 0.1155, 0.2715],
-                     [0.0463, 0.1169, 0.2765],
-                     [0.0466, 0.1189, 0.2825],
-                     [0.0467, 0.1208, 0.2887],
-                     [0.0469, 0.1227, 0.2944]]]],
-                "dos_lm": [[0, 0],
-                   
-                  [
-                  1
-                  , -1],
-                   
-                  [
-                  2
-                  , -1]]
-              }]
-        },
-      "section_system-2": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 2,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[0.0, 0.0, 0.0],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            1.4642683050000002E-10, 1.4642683050000002E-10, 1.4642683050000002E-10]],
-          "simulation_cell": [[0.0, 2.9285366100000004E-10, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 0.0, 2.9285366100000004E-10],
-             
-            [
-            2.9285366100000004E-10, 2.9285366100000004E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Co", "Hf", "V"]
-        },
-      "section_sampling_method-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_sampling_method",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "sampling_method": "geometry_optimization"
-        },
-      "section_frame_sequence-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_frame_sequence",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "frame_sequence_to_sampling_ref": 0,
-          "frame_sequence_local_frames_ref": [0]
-        },
-      "section_method-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_method",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "x_vasp_incarOut_NGY": 28,
-          "x_vasp_incarOut_KBLOCK": 1,
-          "x_vasp_incarOut_LCORR": 1,
-          "x_vasp_incarOut_NBLK": 96,
-          "x_vasp_incarOut_SYSTEM": "CoHf_pvV_sv.T0003.BCA",
-          "x_vasp_incarOut_LREAL": "F",
-          "x_vasp_incarOut_VOSKOWN": 0,
-          "x_vasp_incarOut_LCHARG": 1,
-          "x_vasp_incar_LSCALU": 0,
-          "x_vasp_incar_ISYM": 2,
-          "x_vasp_k_points_generation_method": "Monkhorst-Pack",
-          "x_vasp_incar_ISMEAR": -5,
-          "x_vasp_incar_NSW": 0,
-          "x_vasp_incar_NELM": [120],
-          "x_vasp_incarOut_LVTOT": 0,
-          "x_vasp_incarOut_NGYF": 42,
-          "x_vasp_incarOut_NPACO": 256,
-          "x_vasp_incarOut_NGX": 28,
-          "x_vasp_incar_NBANDS": 66,
-          "x_vasp_incar_LPLANE": 1,
-          "x_vasp_incarOut_IWAVPR": 10,
-          "x_vasp_incarOut_ISTART": 0,
-          "x_vasp_incarOut_IBRION": -1,
-          "x_vasp_incarOut_NSW": 0,
-          "x_vasp_incar_ISIF": 2,
-          "x_vasp_incarOut_ISYM": 2,
-          "x_vasp_incar_LWAVE": 0,
-          "x_vasp_incarOut_GGA": "--",
-          "x_vasp_incarOut_NELM": [120],
-          "x_vasp_incarOut_IALGO": 38,
-          "x_vasp_incar_ISPIN": 1,
-          "x_vasp_incarOut_ISPIN": 1,
-          "x_vasp_incarOut_LSCALU": 0,
-          "x_vasp_incar_NSIM": 4,
-          "x_vasp_incar_LELF": 1,
-          "x_vasp_incarOut_NELMDL": 0,
-          "x_vasp_incar_LORBIT": "F",
-          "x_vasp_incarOut_ISMEAR": -5,
-          "x_vasp_incar_SYSTEM": "CoHf_pvV_sv.T0003.BCA",
-          "x_vasp_incarOut_ICHARG": 2,
-          "x_vasp_incarOut_ISIF": 2,
-          "x_vasp_incarOut_NGXF": 42,
-          "x_vasp_incarOut_NBANDS": 66,
-          "x_vasp_incar_NELMIN": 2,
-          "x_vasp_incarOut_NBLOCK": 1,
-          "x_vasp_incarOut_LELF": 1,
-          "x_vasp_incarOut_NSIM": 4,
-          "x_vasp_incarOut_LWAVE": 0,
-          "x_vasp_incar_PREC": "high",
-          "x_vasp_incar_ALGO": "Normal",
-          "x_vasp_incarOut_LPLANE": 1,
-          "x_vasp_incarOut_NGZ": 28,
-          "x_vasp_incarOut_LASYNC": 0,
-          "x_vasp_incarOut_PREC": "high",
-          "x_vasp_incarOut_INIWAV": 1,
-          "x_vasp_incarOut_LSCALAPACK": 0,
-          "x_vasp_incarOut_LORBIT": "F",
-          "x_vasp_incar_LCHARG": 1,
-          "electronic_structure_method": "DFT",
-          "x_vasp_incarOut_NELMIN": 2,
-          "x_vasp_incarOut_NGZF": 42,
-          "x_vasp_incarOut_NWRITE": 2,
-          "x_vasp_incarOut_LDAU": 0,
-          "x_vasp_incarOut_NPAR": 4,
-          "x_vasp_incar_LREAL": "F",
-          "x_vasp_incar_IBRION": 2,
-          "section_XC_functionals": [{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 0,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_X_PBE"
-              },{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 1,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_C_PBE"
-              }]
-        }},
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 50027.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown array tetrahedronlist in kpoints","Unknown tag i in kpoints","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCOMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    526.56800000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXPAW', 'type': 'int'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMAXMIX', 'type': 'int'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LNONCOLLINEAR', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSORBIT', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LSPIRAL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LZEROZ', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LASPH', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMETAGGA', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA2', 'type': 'string'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    375.15660000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIAG', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NRMM', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IMIX', 'type': 'int'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MAXMIX', 'type': 'int'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'INIMIX', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MIXPRE', 'type': 'int'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'MREMOVE', 'type': 'int'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIPOL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LDIPOL', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ADDGRID', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NFREE', 'type': 'int'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'NEDOS', 'type': 'int'} '  5000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LPARD', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LOPTICS', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LCRITICAL_MEM', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'IDIOT', 'type': 'int'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LMUSIC', 'type': 'logical'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LREAL_COMPAT', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'GGA_COMPAT', 'type': 'logical'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'LBERRY', 'type': 'logical'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ICORELEVEL', 'type': 'int'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'I_CONSTRAINED_M', 'type': 'int'} '     0'","unexpected array named atomtypes in atominfo"]
-  }},
-  "parserStatus": "ParseSuccess"
-}
\ No newline at end of file
diff --git a/src/tmp/8827707185690202207_dos_file2.json b/src/tmp/8827707185690202207_dos_file2.json
deleted file mode 100644
index 7b18a2a2d7c0f02bc9ccd0560edf4d6bfda703d3..0000000000000000000000000000000000000000
--- a/src/tmp/8827707185690202207_dos_file2.json
+++ /dev/null
@@ -1,15751 +0,0 @@
-{
-  "type": "nomad_info_data_json_2_0",
-  "mainFileUri": "nmd://RRTmFUP26VkFHF4wV49YLUzxMO-Ov/data/Be_svPRh_pv/T0003.ABC/vasprun.xml.static",
-  "parserInfo": {
-    "name":"VaspRunParser",
-    "version":"1.0",
-    "parserId":"VaspRunParser1.1.0-dirty",
-    "versionInfo":{
-      "nomadCoreVersion":{
-        "pythonCommonVersion":"1.2.0",
-        "name":"nomadCore",
-        "buildTime":"1475297566899",
-        "scalaVersion":"2.11.7",
-        "version":"1.4.0-1-g39941b7-dirty",
-        "metaInfoVersion":"1.5.0-7-ga9cce07",
-        "sbtVersion":"0.13.11"
-      },
-      "name":"vasp",
-      "buildTime":"1475297565742",
-      "scalaVersion":"2.11.7",
-      "version":"1.1.0-dirty",
-      "sbtVersion":"0.13.11"
-    }
-  },
-  "sections": {
-    "section_run-0": {
-    "type": "nomad_section_1_0",
-    "gIndex": 0,
-    "name": "section_run",
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 16421.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'type': 'int', 'name': 'NEDOS'} '  5000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown array tetrahedronlist in kpoints","Unknown tag i in kpoints","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LCOMPAT'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    531.92600000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'LMAXPAW'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'LMAXMIX'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LNONCOLLINEAR'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LSORBIT'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LSPIRAL'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LZEROZ'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LASPH'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LMETAGGA'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'string', 'name': 'GGA2'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    432.25000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LDIAG'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'NRMM'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'IMIX'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'MAXMIX'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'INIMIX'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'MIXPRE'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'MREMOVE'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'IDIPOL'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LDIPOL'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'ADDGRID'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'NFREE'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'NEDOS'} '  5000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LPARD'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LOPTICS'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LCRITICAL_MEM'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'IDIOT'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LMUSIC'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LREAL_COMPAT'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'GGA_COMPAT'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LBERRY'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'ICORELEVEL'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'I_CONSTRAINED_M'} '     0'","unexpected array named atomtypes in atominfo"],
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-                     [0.0267, 0.1272, 0.3458],
-                     [0.0266, 0.1321, 0.3577],
-                     [0.0269, 0.139, 0.375],
-                     [0.0275, 0.1474, 0.3965],
-                     [0.0282, 0.1569, 0.4208],
-                     [0.0288, 0.166, 0.4437],
-                     [0.0288, 0.1712, 0.4552]]]],
-                "dos_lm": [[0, 0],
-                   
-                  [
-                  1
-                  , -1],
-                   
-                  [
-                  2
-                  , -1]]
-              }]
-        },
-      "section_system-2": {
-          "type": "nomad_section_1_0",
-          "name": "section_system",
-          "gIndex": 2,
-          "references": {
-            "section_run": 0},
-          "atom_positions": [[2.69998791E-10, 2.69998791E-10, 2.69998791E-10],
-             
-            [
-            1.349993955E-10, 1.349993955E-10, 1.349993955E-10],
-             
-            [
-            0.0, 0.0, 0.0]],
-          "simulation_cell": [[0.0, 2.69998791E-10, 2.69998791E-10],
-             
-            [
-            2.69998791E-10, 0.0, 2.69998791E-10],
-             
-            [
-            2.69998791E-10, 2.69998791E-10, 0.0]],
-          "configuration_periodic_dimensions": [
-              [true, true, true]
-              ],
-          "atom_labels": ["Be", "P", "Rh"]
-        },
-      "section_sampling_method-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_sampling_method",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "sampling_method": "geometry_optimization"
-        },
-      "section_frame_sequence-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_frame_sequence",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "frame_sequence_to_sampling_ref": 0,
-          "frame_sequence_local_frames_ref": [0]
-        },
-      "section_method-0": {
-          "type": "nomad_section_1_0",
-          "name": "section_method",
-          "gIndex": 0,
-          "references": {
-            "section_run": 0},
-          "x_vasp_incarOut_NGY": 28,
-          "x_vasp_incarOut_KBLOCK": 1,
-          "x_vasp_incarOut_LCORR": 1,
-          "x_vasp_incarOut_NBLK": 64,
-          "x_vasp_incarOut_SYSTEM": "Be_svPRh_pv.T0003.ABC",
-          "x_vasp_incarOut_LREAL": "F",
-          "x_vasp_incarOut_VOSKOWN": 0,
-          "x_vasp_incarOut_LCHARG": 1,
-          "x_vasp_incar_LSCALU": 0,
-          "x_vasp_incar_ISYM": 2,
-          "x_vasp_k_points_generation_method": "Monkhorst-Pack",
-          "x_vasp_incar_ISMEAR": -5,
-          "x_vasp_incar_NSW": 0,
-          "x_vasp_incar_NELM": [120],
-          "x_vasp_incarOut_LVTOT": 0,
-          "x_vasp_incarOut_NGYF": 40,
-          "x_vasp_incarOut_NPACO": 256,
-          "x_vasp_incarOut_NGX": 28,
-          "x_vasp_incar_NBANDS": 59,
-          "x_vasp_incar_LPLANE": 1,
-          "x_vasp_incarOut_IWAVPR": 10,
-          "x_vasp_incarOut_ISTART": 0,
-          "x_vasp_incarOut_IBRION": -1,
-          "x_vasp_incarOut_NSW": 0,
-          "x_vasp_incar_ISIF": 2,
-          "x_vasp_incarOut_ISYM": 2,
-          "x_vasp_incar_LWAVE": 0,
-          "x_vasp_incarOut_GGA": "--",
-          "x_vasp_incarOut_NELM": [120],
-          "x_vasp_incarOut_IALGO": 38,
-          "x_vasp_incar_ISPIN": 1,
-          "x_vasp_incarOut_ISPIN": 1,
-          "x_vasp_incarOut_LSCALU": 0,
-          "x_vasp_incar_NSIM": 4,
-          "x_vasp_incar_LELF": 1,
-          "x_vasp_incarOut_NELMDL": 0,
-          "x_vasp_incar_LORBIT": "F",
-          "x_vasp_incarOut_ISMEAR": -5,
-          "x_vasp_incar_SYSTEM": "Be_svPRh_pv.T0003.ABC",
-          "x_vasp_incarOut_ICHARG": 2,
-          "x_vasp_incarOut_ISIF": 2,
-          "x_vasp_incarOut_NGXF": 40,
-          "x_vasp_incarOut_NBANDS": 59,
-          "x_vasp_incar_NELMIN": 2,
-          "x_vasp_incarOut_NBLOCK": 1,
-          "x_vasp_incarOut_LELF": 1,
-          "x_vasp_incarOut_NSIM": 4,
-          "x_vasp_incarOut_LWAVE": 0,
-          "x_vasp_incar_PREC": "high",
-          "x_vasp_incar_ALGO": "Normal",
-          "x_vasp_incarOut_LPLANE": 1,
-          "x_vasp_incarOut_NGZ": 28,
-          "x_vasp_incarOut_LASYNC": 0,
-          "x_vasp_incarOut_PREC": "high",
-          "x_vasp_incarOut_INIWAV": 1,
-          "x_vasp_incarOut_LSCALAPACK": 0,
-          "x_vasp_incarOut_LORBIT": "F",
-          "x_vasp_incar_LCHARG": 1,
-          "electronic_structure_method": "DFT",
-          "x_vasp_incarOut_NELMIN": 2,
-          "x_vasp_incarOut_NGZF": 40,
-          "x_vasp_incarOut_NWRITE": 2,
-          "x_vasp_incarOut_LDAU": 0,
-          "x_vasp_incarOut_NPAR": 4,
-          "x_vasp_incar_LREAL": "F",
-          "x_vasp_incar_IBRION": 2,
-          "section_XC_functionals": [{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 0,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_X_PBE"
-              },{
-                "type": "nomad_section_1_0",
-                "name": "section_XC_functionals",
-                "gIndex": 1,
-                "references": {
-                  "section_method": 0},
-                "XC_functional_name": "GGA_C_PBE"
-              }]
-        }},
-    "program_version": "4.6.35  3Apr08 complex  parallel LinuxIFC",
-    "program_name": "vasp",
-    "program_compilation_datetime": 16421.0,
-    "program_basis_set_type": "plane waves",
-    "parsing_message_warning_run": ["Unknown INCAR parameter (not registered in the meta data): i {'type': 'int', 'name': 'NEDOS'} '  5000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown array tetrahedronlist in kpoints","Unknown tag i in kpoints","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LCOMPAT'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENAUG'} '    531.92600000'","unexpected tag v {'name': 'ROPT'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'LMAXPAW'} '  -100'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'LMAXMIX'} '     2'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LNONCOLLINEAR'} ' F  '","unexpected tag v {'name': 'MAGMOM'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LSORBIT'} ' F  '","unexpected tag v {'name': 'SAXIS'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LSPIRAL'} ' F  '","unexpected tag v {'name': 'QSPIRAL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LZEROZ'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LASPH'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LMETAGGA'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'string', 'name': 'GGA2'} '--'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'ENINI'} '    432.25000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LDIAG'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'NRMM'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIN'} '      0.10000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'AMIX_MAG'} '      1.60000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'BMIX_MAG'} '      1.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'IMIX'} '     4'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'MAXMIX'} '   -45'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'WC'} '    100.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'INIMIX'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'MIXPRE'} '     1'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'MREMOVE'} '     5'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'IDIPOL'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LDIPOL'} ' F  '","unexpected tag v {'name': 'DIPOL'} in parameters at depth 1","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EFIELD'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'ADDGRID'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'PSTRESS'} '      0.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'NFREE'} '     1'","unexpected tag v {'name': 'RWIGS'} in parameters separator dos at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'NEDOS'} '  5000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMIN'} '    -30.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'name': 'EMAX'} '     45.00000000'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LPARD'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LOPTICS'} ' F  '","unexpected tag v {'name': 'STM'} in parameters separator writing at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LCRITICAL_MEM'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'IDIOT'} '     3'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LMUSIC'} ' F  '","unexpected tag v {'name': 'POMASS'} in parameters separator miscellaneous at depth 0","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LREAL_COMPAT'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'GGA_COMPAT'} ' T  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'logical', 'name': 'LBERRY'} ' F  '","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'ICORELEVEL'} '     0'","Unknown INCAR out parameter (not registered in the meta data): i {'type': 'int', 'name': 'I_CONSTRAINED_M'} '     0'","unexpected array named atomtypes in atominfo"]
-  }},
-  "parserStatus": "ParseSuccess"
-}
\ No newline at end of file