Commit fea361ec authored by Markus Scheidgen's avatar Markus Scheidgen
Browse files

Added section for archive processing information.

parent fa8e7ecc
......@@ -2112,6 +2112,38 @@
"superNames": [
"section_system"
]
}, {
"description": "Internal nomad upload id",
"dtypeStr": "C",
"name": "upload_id",
"shape": [],
"superNames": [
"section_calculation_info"
]
}, {
"description": "Internal nomad upload hash",
"dtypeStr": "C",
"name": "upload_hash",
"shape": [],
"superNames": [
"section_calculation_info"
]
}, {
"description": "Internal nomad calc hash",
"dtypeStr": "C",
"name": "calc_hash",
"shape": [],
"superNames": [
"section_calculation_info"
]
}, {
"description": "Nomad archive id for this calculation.",
"dtypeStr": "C",
"name": "archive_id",
"shape": [],
"superNames": [
"section_calculation_info"
]
}, {
"description": "nomad uri identifying the main file corresponding to this calculation",
"dtypeStr": "C",
......@@ -2120,6 +2152,14 @@
"superNames": [
"section_calculation_info"
]
}, {
"description": "Path to the main file within the upload.",
"dtypeStr": "C",
"name": "main_file",
"shape": [],
"superNames": [
"section_calculation_info"
]
}, {
"description": "An array of the dimension of number_of_atoms where each atom (identified by the index in the array) is assigned to an atom-centered basis set, for this section_single_configuration_calculation. The actual definition of the atom-centered basis set is in the section_basis_set_atom_centered that is referred to by this metadata.",
"dtypeStr": "r",
......@@ -2664,7 +2704,7 @@
"accessory_info"
]
}, {
"description": "Status returned by the first parser that thranslated the main_file_uri",
"description": "Status returned by the first parser that translated the main_file_uri",
"dtypeStr": "C",
"name": "parse_status",
"shape": [],
......@@ -2677,6 +2717,59 @@
"ParseSuccess": "Parsing was successfull (does not mean that the file is valid or meaningful, simply that the parser could process it)",
"ParseWithWarnings": "The Parser had serious warnings"
}
}, {
"description": "Information about the used archive processing steps and their execution.",
"kindStr": "type_section",
"name": "section_archive_processing_info",
"repeats": true,
"superNames": [
"section_calculation_info"
]
}, {
"description": "Name of the applied archive processing program.",
"dtypeStr": "C",
"name": "archive_processor_name",
"shape": [],
"superNames": [
"section_archive_processing_info"
]
}, {
"description": "The main error during execution of the archive processing program that failed the program.",
"dtypeStr": "C",
"name": "archive_processor_error",
"shape": [],
"superNames": [
"section_archive_processing_info"
]
}, {
"description": "Number of warnings during execution of the archive processing program.",
"dtypeStr": "i",
"kindStr": "type_dimension",
"name": "archive_processor_warning_number",
"superNames": [
"section_archive_processing_info"
]
}, {
"description": "Warnings during execution of the archive processing program.",
"dtypeStr": "C",
"name": "archive_processor_warnings",
"shape": [ "archive_processor_warning_number" ],
"superNames": [
"section_archive_processing_info"
]
}, {
"description": "Status returned by archive processing program.",
"dtypeStr": "C",
"name": "archive_processor_status",
"shape": [],
"superNames": [
"section_archive_processing_info"
],
"values": {
"Failure": "The program failed.",
"Success": "The program was successful.",
"WithWarnings": "The program had serious warnings"
}
}, {
"description": "id of the parser used to extract this information",
"dtypeStr": "C",
......
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