Commit d9cbb3db authored by Hagen-Henrik Kowalski's avatar Hagen-Henrik Kowalski
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parent 82bd9411
{ {
"type": "nomad_meta_info_1_0", "type": "nomad_meta_info_1_0",
"description": "Phonopy meta info, not specific to any code", "description": "Phonopy meta info, not specific to any code",
"dependencies": [ {
"relativePath": "common.nomadmetainfo.json"
}],
"metaInfos": [ { "metaInfos": [ {
"description": "Information about properties that concerne phonopy calculations.", "description": "Information about properties that concerne phonopy calculations.",
"kindStr": "type_abstract_document_content", "kindStr": "type_document_content",
"name": "accessory_info", "name": "phonopy_info",
"superNames": [] "superNames": []
}, },
{ {
"description": "Aplitude of the atom diplacement for the phonopy supercell" "description": "Aplitude of the atom diplacement for the phonopy supercell"
"dtypeStr": f "dtypeStr": "f"
"name": "displacement" "name": "x_phonopy_displacement"
"shape": [] "shape": []
"units": "m" "units": "m"
}, },
{ {
"description": "Matrix that transforms the primitive lattice into th supercell lattice"
"dtypeStr": f
"name": "SC_matrix"
"shape": [3,3]
},
{
"description": "Symmetrie threshold for the space group identification of the crystal for which the vibrational properties are to be calculated"
"dtypeStr": "f"
"name": "symprec"
"shape": []
"units": "m"
},
{
"description": "Symmetrie threshold for the space group identification of the crystal for which the vibrational properties are to be calculated" "description": "Symmetrie threshold for the space group identification of the crystal for which the vibrational properties are to be calculated"
"dtypeStr": "f" "dtypeStr": "f"
"name": "symprec" "name": "x_phonopy_symprec"
"shape": [] "shape": []
"units": "m" "units": "m"
}, }
] ]
} }
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