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Georgi Krastev
nomad-meta-info
Commits
64f94e7f
Commit
64f94e7f
authored
Oct 25, 2016
by
Mikkel Strange
Browse files
x_asap... meta info
parent
87d00bd2
Changes
1
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meta_info/nomad_meta_info/asap.nomadmetainfo.json
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64f94e7f
...
...
@@ -6,5 +6,37 @@
},
{
"relativePath"
:
"common.nomadmetainfo.json"
}],
"metaInfos"
:
[
]
"metaInfos"
:
[
{
"description"
:
"Friction coeffient used in Langevin dynamics"
,
"dtypeStr"
:
"f"
,
"name"
:
"x_asap_langevin_friction"
,
"shape"
:
[],
"superNames"
:
[
"section_sampling_method"
]
},
{
"description"
:
"Maxstep in Angstrom for geometry optimization"
,
"dtypeStr"
:
"f"
,
"name"
:
"x_asap_maxstep"
,
"shape"
:
[],
"superNames"
:
[
"section_sampling_method"
]
},
{
"description"
:
"Temperature used in molecular-dynamics"
,
"dtypeStr"
:
"f"
,
"name"
:
"x_asap_temperature"
,
"shape"
:
[],
"superNames"
:
[
"section_sampling_method"
]
},
{
"description"
:
"Timestep in molecular dynamics"
,
"dtypeStr"
:
"f"
,
"name"
:
"x_asap_timestep"
,
"shape"
:
[],
"superNames"
:
[
"section_sampling_method"
]
}]
}
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