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Georgi Krastev
nomad-meta-info
Commits
defeb5e6
Commit
defeb5e6
authored
Nov 16, 2016
by
Pardini, Lorenzo (lopa)
Browse files
added x_elk_section_atoms_group
parent
af5b3070
Changes
1
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Inline
Side-by-side
meta_info/nomad_meta_info/elk.nomadmetainfo.json
View file @
defeb5e6
...
...
@@ -110,7 +110,7 @@
"repeats"
:
true
,
"shape"
:
[],
"superNames"
:
[
"section_
system
"
"
x_elk_
section_
atoms_group
"
]
},
{
"description"
:
"muffin-tin radius"
,
...
...
@@ -134,7 +134,7 @@
"repeats"
:
true
,
"shape"
:
[],
"superNames"
:
[
"section_
system
"
"
x_elk_
section_
atoms_group
"
]
},
{
"description"
:
"x component of atomic position"
,
...
...
@@ -143,7 +143,7 @@
"repeats"
:
true
,
"shape"
:
[],
"superNames"
:
[
"section_
system
"
"
x_elk_
section_
atoms_group
"
],
"units"
:
"m"
},
{
...
...
@@ -153,7 +153,7 @@
"repeats"
:
true
,
"shape"
:
[],
"superNames"
:
[
"section_
system
"
"
x_elk_
section_
atoms_group
"
],
"units"
:
"m"
},
{
...
...
@@ -163,10 +163,17 @@
"repeats"
:
true
,
"shape"
:
[],
"superNames"
:
[
"section_
system
"
"
x_elk_
section_
atoms_group
"
],
"units"
:
"m"
},
{
},
{
"description"
:
"a group of atoms of the same type"
,
"kindStr"
:
"type_section"
,
"name"
:
"x_elk_section_atoms_group"
,
"superNames"
:
[
"section_system"
]
},
{
"description"
:
"number k-points x"
,
"dtypeStr"
:
"i"
,
"name"
:
"x_elk_number_kpoint_x"
,
...
...
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