Oqmd Structure
GET /third-parties/OqmdStructure/?format=api&ordering=-id&page=22
https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-id&page=23", "previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-id&page=21", "results": [ { "id": "oqmd-999748", "created_at": "2022-09-04T15:26:16.271674Z", "updated_at": "2022-09-04T15:26:16.271694Z", "structure_string": "Cd1 Co1 Cu1 Te1\n1.0\n0.000000 3.303294 3.303294\n3.303294 0.000000 3.303294\n3.303294 3.303294 0.000000\nCd Co Cu Te\n1 1 1 1\ndirect\n0.499999 0.499999 0.499999 Cd\n0.000000 0.000000 0.000000 Co\n0.750000 0.750000 0.750000 Cu\n0.249999 0.249999 0.249999 Te\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Co", "Cu", "Te" ], "chemical_system": "Cd-Co-Cu-Te", "density": 8.349753991606617, "density_atomic": 0.0554866250836978, "volume": 72.08944487011549, "volume_molar": 10.853319607952384, "formula_full": "Cd1 Co1 Cu1 Te1", "formula_reduced": "CdCoCuTe", "formula_anonymous": "ABCD", "formation_energy": 0.531155559166668, "spacegroup": 216 }, { "id": "oqmd-999747", "created_at": "2022-09-04T15:26:16.555167Z", "updated_at": "2022-09-04T15:26:16.555194Z", "structure_string": "Cd1 Co1 Cu1 Te1\n1.0\n0.000000 3.364062 3.364062\n3.364062 0.000000 3.364062\n3.364062 3.364062 0.000000\nCd Co Cu Te\n1 1 1 1\ndirect\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Co\n0.750000 0.750000 0.750000 Cu\n0.500000 0.500000 0.500000 Te\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Co", "Cu", "Te" ], "chemical_system": "Cd-Co-Cu-Te", "density": 7.905391669702893, "density_atomic": 0.052533703886069906, "volume": 76.14159490209978, "volume_molar": 11.463385054783583, "formula_full": "Cd1 Co1 Cu1 Te1", "formula_reduced": "CdCoCuTe", "formula_anonymous": "ABCD", "formation_energy": 0.604994576666667, "spacegroup": 216 }, { "id": "oqmd-999746", "created_at": "2022-09-04T15:26:16.293628Z", "updated_at": "2022-09-04T15:26:16.293638Z", "structure_string": "Cd1 Cu1 Te1 Rh1\n1.0\n0.000000 3.294508 3.294508\n3.294508 0.000000 3.294508\n3.294508 3.294508 0.000000\nCd Cu Rh Te\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750000 0.750000 0.750000 Cu\n0.250001 0.250001 0.250001 Rh\n0.500000 0.500000 0.500000 Te\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Rh", "Te" ], "chemical_system": "Cd-Cu-Rh-Te", "density": 9.437737339760242, "density_atomic": 0.0559317356317842, "volume": 71.5157495975671, "volume_molar": 10.76694776583656, "formula_full": "Cd1 Cu1 Te1 Rh1", "formula_reduced": "CdCuTeRh", "formula_anonymous": "ABCD", "formation_energy": 0.0977469741666677, "spacegroup": 216 }, { "id": "oqmd-999745", "created_at": "2022-09-04T15:26:16.904748Z", "updated_at": "2022-09-04T15:26:16.904774Z", "structure_string": "Cd1 Cu1 Te1 Rh1\n1.0\n0.000000 3.312745 3.312745\n3.312745 0.000000 3.312745\n3.312745 3.312745 0.000000\nCd Cu Rh Te\n1 1 1 1\ndirect\n0.499999 0.499999 0.499999 Cd\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Rh\n0.250001 0.250001 0.250001 Te\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Rh", "Te" ], "chemical_system": "Cd-Cu-Rh-Te", "density": 9.282726702067428, "density_atomic": 0.055013081753695986, "volume": 72.70997865396379, "volume_molar": 10.946743152769132, "formula_full": "Cd1 Cu1 Te1 Rh1", "formula_reduced": "CdCuTeRh", "formula_anonymous": "ABCD", "formation_energy": 0.244987071666668, "spacegroup": 216 }, { "id": "oqmd-999744", "created_at": "2022-09-04T15:26:16.631786Z", "updated_at": "2022-09-04T15:26:16.631810Z", "structure_string": "Cd1 Cu1 Te1 Rh1\n1.0\n0.000000 3.331229 3.331229\n3.331229 0.000000 3.331229\n3.331229 3.331229 0.000000\nCd Cu Rh Te\n1 1 1 1\ndirect\n0.249999 0.249999 0.249999 Cd\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 Te\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Rh", "Te" ], "chemical_system": "Cd-Cu-Rh-Te", "density": 9.129061231314825, "density_atomic": 0.054102399862851314, "volume": 73.93387373092384, "volume_molar": 11.131004863492242, "formula_full": "Cd1 Cu1 Te1 Rh1", "formula_reduced": "CdCuTeRh", "formula_anonymous": "ABCD", "formation_energy": 0.306085409166668, "spacegroup": 216 }, { "id": "oqmd-999743", "created_at": "2022-09-04T15:26:16.651958Z", "updated_at": "2022-09-04T15:26:16.651984Z", "structure_string": "Cd1 Cu1 Sb1 Pd1\n1.0\n0.000000 3.331996 3.331996\n3.331996 0.000000 3.331996\n3.331996 3.331996 0.000000\nCd Cu Pd Sb\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750001 0.750001 0.750001 Cu\n0.500001 0.500001 0.500001 Pd\n0.250000 0.250000 0.250000 Sb\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "Sb" ], "chemical_system": "Cd-Cu-Pd-Sb", "density": 9.070564187849106, "density_atomic": 0.05406504658639952, "volume": 73.98495428294389, "volume_molar": 11.138695220351325, "formula_full": "Cd1 Cu1 Sb1 Pd1", "formula_reduced": "CdCuSbPd", "formula_anonymous": "ABCD", "formation_energy": 0.0555166862499998, "spacegroup": 216 }, { "id": "oqmd-999742", "created_at": "2022-09-04T15:26:17.023466Z", "updated_at": "2022-09-04T15:26:17.023491Z", "structure_string": "V1 Cd1 Cu1 Pd1\n1.0\n0.000000 3.142817 3.142817\n3.142817 0.000000 3.142817\n3.142817 3.142817 0.000000\nCd Cu Pd V\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750001 0.750001 0.750001 Cu\n0.499999 0.499999 0.499999 Pd\n0.250000 0.250000 0.250000 V\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "V" ], "chemical_system": "Cd-Cu-Pd-V", "density": 8.91499778492763, "density_atomic": 0.06442771289859471, "volume": 62.0850845085213, "volume_molar": 9.347127950170268, "formula_full": "V1 Cd1 Cu1 Pd1", "formula_reduced": "VCdCuPd", "formula_anonymous": "ABCD", "formation_energy": 0.149828997499999, "spacegroup": 216 }, { "id": "oqmd-999741", "created_at": "2022-09-04T15:26:17.281814Z", "updated_at": "2022-09-04T15:26:17.281839Z", "structure_string": "V1 Cd1 Cu1 Pd1\n1.0\n0.000000 3.143492 3.143492\n3.143492 0.000000 3.143492\n3.143492 3.143492 0.000000\nCd Cu Pd V\n1 1 1 1\ndirect\n0.499998 0.499998 0.499998 Cd\n0.750000 0.750000 0.750000 Cu\n0.250001 0.250001 0.250001 Pd\n0.000000 0.000000 0.000000 V\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "V" ], "chemical_system": "Cd-Cu-Pd-V", "density": 8.909256082925282, "density_atomic": 0.06438621824687622, "volume": 62.12509616052912, "volume_molar": 9.35315184518105, "formula_full": "V1 Cd1 Cu1 Pd1", "formula_reduced": "VCdCuPd", "formula_anonymous": "ABCD", "formation_energy": 0.089161045, "spacegroup": 216 }, { "id": "oqmd-999740", "created_at": "2022-09-04T15:26:17.375714Z", "updated_at": "2022-09-04T15:26:17.375746Z", "structure_string": "V1 Cd1 Cu1 Pd1\n1.0\n0.000000 3.160947 3.160947\n3.160947 0.000000 3.160947\n3.160947 3.160947 0.000000\nCd Cu Pd V\n1 1 1 1\ndirect\n0.249999 0.249999 0.249999 Cd\n0.750000 0.750000 0.750000 Cu\n0.500001 0.500001 0.500001 Pd\n0.000000 0.000000 0.000000 V\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "V" ], "chemical_system": "Cd-Cu-Pd-V", "density": 8.7624767463723, "density_atomic": 0.06332546005231225, "volume": 63.165747184397205, "volume_molar": 9.509825518875342, "formula_full": "V1 Cd1 Cu1 Pd1", "formula_reduced": "VCdCuPd", "formula_anonymous": "ABCD", "formation_energy": 0.1602495825, "spacegroup": 216 }, { "id": "oqmd-999739", "created_at": "2022-09-04T15:26:16.512693Z", "updated_at": "2022-09-04T15:26:16.512726Z", "structure_string": "Ta1 Cd1 Cu1 Pd1\n1.0\n0.000000 3.191142 3.191142\n3.191142 0.000000 3.191142\n3.191142 3.191142 0.000000\nCd Cu Pd Ta\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750001 0.750001 0.750001 Cu\n0.500000 0.500000 0.500000 Pd\n0.250000 0.250000 0.250000 Ta\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "Ta" ], "chemical_system": "Cd-Cu-Pd-Ta", "density": 11.837672861830137, "density_atomic": 0.06154483417286702, "volume": 64.99326960187767, "volume_molar": 9.784965449878412, "formula_full": "Ta1 Cd1 Cu1 Pd1", "formula_reduced": "TaCdCuPd", "formula_anonymous": "ABCD", "formation_energy": 0.1449333175, "spacegroup": 216 }, { "id": "oqmd-999738", "created_at": "2022-09-04T15:26:16.483103Z", "updated_at": "2022-09-04T15:26:16.483118Z", "structure_string": "Ta1 Cd1 Cu1 Pd1\n1.0\n0.000000 3.186544 3.186544\n3.186544 0.000000 3.186544\n3.186544 3.186544 0.000000\nCd Cu Pd Ta\n1 1 1 1\ndirect\n0.499999 0.499999 0.499999 Cd\n0.750001 0.750001 0.750001 Cu\n0.250001 0.250001 0.250001 Pd\n0.000000 0.000000 0.000000 Ta\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "Ta" ], "chemical_system": "Cd-Cu-Pd-Ta", "density": 11.88899008488752, "density_atomic": 0.06181163576640172, "volume": 64.71273491477857, "volume_molar": 9.742729965534078, "formula_full": "Ta1 Cd1 Cu1 Pd1", "formula_reduced": "TaCdCuPd", "formula_anonymous": "ABCD", "formation_energy": -0.0159373, "spacegroup": 216 }, { "id": "oqmd-999737", "created_at": "2022-09-04T15:26:16.996911Z", "updated_at": "2022-09-04T15:26:16.996931Z", "structure_string": "Ta1 Cd1 Cu1 Pd1\n1.0\n0.000000 3.178497 3.178497\n3.178497 0.000000 3.178497\n3.178497 3.178497 0.000000\nCd Cu Pd Ta\n1 1 1 1\ndirect\n0.250000 0.250000 0.250000 Cd\n0.750001 0.750001 0.750001 Cu\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Ta\n", "nsites": 4, "nelements": 4, "elements": [ "Cd", "Cu", "Pd", "Ta" ], "chemical_system": "Cd-Cu-Pd-Ta", "density": 11.979516944381729, "density_atomic": 0.06228229082004205, "volume": 64.22371347190115, "volume_molar": 9.669106066442426, "formula_full": "Ta1 Cd1 Cu1 Pd1", "formula_reduced": "TaCdCuPd", "formula_anonymous": "ABCD", "formation_energy": 0.199251545, "spacegroup": 216 } ] }{ "count": 1013513, "next": "