Oqmd Structure
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"oqmd-998963", "created_at": "2022-09-04T15:26:13.976678Z", "updated_at": "2022-09-04T15:26:13.976700Z", "structure_string": "Cu1 Sn1 As1 Os1\n1.0\n0.000000 3.248312 3.248312\n3.248312 0.000000 3.248312\n3.248312 3.248312 0.000000\nAs Cu Os Sn\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 As\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Os\n0.250001 0.250001 0.250001 Sn\n", "nsites": 4, "nelements": 4, "elements": [ "As", "Cu", "Os", "Sn" ], "chemical_system": "As-Cu-Os-Sn", "density": 10.838002562253992, "density_atomic": 0.058352139757741645, "volume": 68.5493285525886, "volume_molar": 10.320342638679392, "formula_full": "Cu1 Sn1 As1 Os1", "formula_reduced": "CuSnAsOs", "formula_anonymous": "ABCD", "formation_energy": 0.652244417037199, "spacegroup": 216 }, { "id": "oqmd-998962", "created_at": "2022-09-04T15:26:14.913778Z", "updated_at": "2022-09-04T15:26:14.913816Z", "structure_string": "Cu1 Sn1 As1 Os1\n1.0\n0.000000 3.217755 3.217755\n3.217755 0.000000 3.217755\n3.217755 3.217755 0.000000\nAs Cu Os Sn\n1 1 1 1\ndirect\n0.250000 0.250000 0.250000 As\n0.750001 0.750001 0.750001 Cu\n0.000000 0.000000 0.000000 Os\n0.499999 0.499999 0.499999 Sn\n", "nsites": 4, "nelements": 4, "elements": [ "As", "Cu", "Os", "Sn" ], "chemical_system": "As-Cu-Os-Sn", "density": 11.149709120016988, "density_atomic": 0.060030377469673706, "volume": 66.63293100265328, "volume_molar": 10.031822243733648, "formula_full": "Cu1 Sn1 As1 Os1", "formula_reduced": "CuSnAsOs", "formula_anonymous": "ABCD", "formation_energy": 0.665745362037199, "spacegroup": 216 }, { "id": "oqmd-998961", "created_at": "2022-09-04T15:26:13.865258Z", "updated_at": "2022-09-04T15:26:13.865283Z", "structure_string": "Cu1 Si1 As1 Ru1\n1.0\n0.000000 3.031512 3.031512\n3.031512 0.000000 3.031512\n3.031512 3.031512 0.000000\nAs Cu Ru Si\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 As\n0.750000 0.750000 0.750000 Cu\n0.250001 0.250001 0.250001 Ru\n0.500000 0.500000 0.500000 Si\n", "nsites": 4, 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"2022-09-04T15:26:13.740842Z", "structure_string": "Mn1 Cu1 Sb1 As1\n1.0\n0.000000 3.324780 3.324780\n3.324780 0.000000 3.324780\n3.324780 3.324780 0.000000\nAs Cu Mn Sb\n1 1 1 1\ndirect\n0.250000 0.250000 0.250000 As\n0.750000 0.750000 0.750000 Cu\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Sb\n", "nsites": 4, "nelements": 4, "elements": [ "As", "Cu", "Mn", "Sb" ], "chemical_system": "As-Cu-Mn-Sb", "density": 7.119823574440781, "density_atomic": 0.05441783449013417, "volume": 73.5053137905587, "volume_molar": 11.06648365636784, "formula_full": "Mn1 Cu1 Sb1 As1", "formula_reduced": "MnCuSbAs", "formula_anonymous": "ABCD", "formation_energy": 0.410362969051725, "spacegroup": 216 } ] }{ "count": 1013513, "next": "