Commit 5820101a authored by Daria M. Tomecka's avatar Daria M. Tomecka

update example input for testing

parent 8eea4f80
...@@ -2,9 +2,15 @@ ...@@ -2,9 +2,15 @@
"type": "nomad_section_2_0", "type": "nomad_section_2_0",
"name": "section_system", "name": "section_system",
"gIndex": 0, "gIndex": 0,
"uri": "nmd://NcC8TDWGWCtQLhWeB2a1N8y9Q7y4r/CkudBi2tW4arm9RpQeCeKGh1ydES7/section_run/0c/section_system/0c", "uri": "nmd://NcC8TDWGWCtQLhWeB2a1N8y9Q7y4r/Cx_ur73_FOgMaVin27w-dT6nh3dvN/section_run/0c/section_system/0c",
"atom_labels": [{"flatData":["In","In"],"shape":[2]},{"flatData":["In","In"],"shape":[2]}], "atom_labels": {"flatData":["In"],"shape":[1]},
"atom_positions": [{"flatData":[0.0,0.0,0.0,1.62382093E-10,-9.375134687502691E-11,2.6778201450000004E-10],"shape":[2,3]},{"flatData":[0.0,0.0,0.0,1.62382093E-10,-9.375134687502691E-11,2.6778201450000004E-10],"shape":[2,3]}], "atom_positions": {"flatData":[0.0,0.0,0.0],"shape":[1,3]},
"atom_species": [49],
"configuration_periodic_dimensions": [{"flatData":[true,true,true],"shape":[3]}], "configuration_periodic_dimensions": [{"flatData":[true,true,true],"shape":[3]}],
"simulation_cell": {"flatData":[1.62382093E-10,-2.81254035E-10,0.0,1.62382093E-10,2.81254035E-10,0.0,0.0,0.0,5.355640290000001E-10],"shape":[3,3]} "configuration_raw_gid": "sFV4VoynKptGQGWvApuzXo5fNXgs4",
"lattice_vectors": {"flatData":[-1.83172656E-10,1.83172656E-10,1.83172656E-10,1.83172656E-10,-1.83172656E-10,1.83172656E-10,1.83172656E-10,1.83172656E-10,-1.83172656E-10],"shape":[3,3]},
"simulation_cell": {"flatData":[-1.83172656E-10,1.83172656E-10,1.83172656E-10,1.83172656E-10,-1.83172656E-10,1.83172656E-10,1.83172656E-10,1.83172656E-10,-1.83172656E-10],"shape":[3,3]},
"system_composition": "In",
"system_configuration_consistent": true,
"system_reweighted_composition": "In100"
} }
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