Oqmd Structure
GET /third-parties/OqmdStructure/?format=api&ordering=id&page=104
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"oqmd-1001224", "created_at": "2022-09-04T15:26:27.364051Z", "updated_at": "2022-09-04T15:26:27.364072Z", "structure_string": "Li1 Mn1 Cu1 Rh1\n1.0\n0.000000 2.964506 2.964506\n2.964506 0.000000 2.964506\n2.964506 2.964506 0.000000\nCu Li Mn Rh\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.249999 0.249999 0.249999 Li\n0.000000 0.000000 0.000000 Mn\n0.500001 0.500001 0.500001 Rh\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Li", "Mn", "Rh" ], "chemical_system": "Cu-Li-Mn-Rh", "density": 7.276559988713338, "density_atomic": 0.07676672171173445, "volume": 52.10591140025934, "volume_molar": 7.844728322011262, "formula_full": "Li1 Mn1 Cu1 Rh1", "formula_reduced": "LiMnCuRh", "formula_anonymous": "ABCD", "formation_energy": 0.0082628240517248, "spacegroup": 216 }, { "id": "oqmd-1001225", "created_at": "2022-09-04T15:26:26.735564Z", "updated_at": "2022-09-04T15:26:26.735584Z", "structure_string": "Li1 Mn1 Cu1 Rh1\n1.0\n0.000000 2.948939 2.948939\n2.948939 0.000000 2.948939\n2.948939 2.948939 0.000000\nCu Li Mn Rh\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.250000 Rh\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Li", "Mn", "Rh" ], "chemical_system": "Cu-Li-Mn-Rh", "density": 7.392404927002425, "density_atomic": 0.07798887011058574, "volume": 51.28936980787293, "volume_molar": 7.721795111867624, "formula_full": "Li1 Mn1 Cu1 Rh1", "formula_reduced": "LiMnCuRh", "formula_anonymous": "ABCD", "formation_energy": -0.0692396434482756, "spacegroup": 216 }, { "id": "oqmd-1001226", "created_at": "2022-09-04T15:26:26.718446Z", "updated_at": "2022-09-04T15:26:26.718455Z", "structure_string": "Li1 Mn1 Cu1 Rh1\n1.0\n0.000000 2.985672 2.985672\n2.985672 0.000000 2.985672\n2.985672 2.985672 0.000000\nCu Li Mn Rh\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Li\n0.250001 0.250001 0.250001 Mn\n0.500001 0.500001 0.500001 Rh\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Li", "Mn", "Rh" ], "chemical_system": "Cu-Li-Mn-Rh", "density": 7.122899704914265, "density_atomic": 0.07514562654274713, "volume": 53.229977365676376, "volume_molar": 8.01396040869293, "formula_full": "Li1 Mn1 Cu1 Rh1", "formula_reduced": "LiMnCuRh", "formula_anonymous": "ABCD", "formation_energy": -0.0349471159482757, "spacegroup": 216 }, { "id": "oqmd-1001227", "created_at": "2022-09-04T15:26:27.681144Z", "updated_at": "2022-09-04T15:26:27.681172Z", "structure_string": "Li1 Cu1 Os1 Ru1\n1.0\n0.000000 2.922468 2.922468\n2.922468 0.000000 2.922468\n2.922468 2.922468 0.000000\nCu Li Os Ru\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.249999 0.249999 0.249999 Li\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Ru\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Li", "Os", "Ru" ], "chemical_system": "Cu-Li-Os-Ru", "density": 12.034353537008377, "density_atomic": 0.08012733567597873, "volume": 49.92054167600577, "volume_molar": 7.515713219708827, "formula_full": "Li1 Cu1 Os1 Ru1", "formula_reduced": "LiCuOsRu", "formula_anonymous": "ABCD", "formation_energy": 0.570863612499999, "spacegroup": 216 }, { "id": "oqmd-1001228", "created_at": "2022-09-04T15:26:27.343823Z", "updated_at": "2022-09-04T15:26:27.343835Z", "structure_string": "Li1 Cu1 Os1 Ru1\n1.0\n0.000000 2.950725 2.950725\n2.950725 0.000000 2.950725\n2.950725 2.950725 0.000000\nCu Li Os Ru\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.499999 0.499999 0.499999 Li\n0.250001 0.250001 0.250001 Os\n0.000000 0.000000 0.000000 Ru\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Li", "Os", "Ru" ], "chemical_system": "Cu-Li-Os-Ru", "density": 11.691920412991138, "density_atomic": 0.07784734167461219, "volume": 51.382615179324645, "volume_molar": 7.735833530670142, "formula_full": "Li1 Cu1 Os1 Ru1", "formula_reduced": "LiCuOsRu", "formula_anonymous": "ABCD", "formation_energy": 0.19782141, "spacegroup": 216 }, { "id": "oqmd-1001229", "created_at": "2022-09-04T15:26:27.474655Z", "updated_at": "2022-09-04T15:26:27.474679Z", "structure_string": "Li1 Cu1 Os1 Ru1\n1.0\n0.000000 2.959519 2.959519\n2.959519 0.000000 2.959519\n2.959519 2.959519 0.000000\nCu Li Os Ru\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Os\n0.250000 0.250000 0.250000 Ru\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Li", "Os", "Ru" ], "chemical_system": "Cu-Li-Os-Ru", "density": 11.588004676551082, "density_atomic": 0.07715544816573834, "volume": 51.84339013114877, "volume_molar": 7.8052048211343195, "formula_full": "Li1 Cu1 Os1 Ru1", "formula_reduced": "LiCuOsRu", "formula_anonymous": "ABCD", "formation_energy": 0.189981969999999, "spacegroup": 216 }, { "id": "oqmd-1001230", "created_at": "2022-09-04T15:26:26.756362Z", "updated_at": "2022-09-04T15:26:26.756391Z", "structure_string": "Lu1 Cu1 Ni1 Pb1\n1.0\n0.000000 3.317474 3.317474\n3.317474 0.000000 3.317474\n3.317474 3.317474 0.000000\nCu Lu Ni Pb\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Lu\n0.499999 0.499999 0.499999 Ni\n0.249999 0.249999 0.249999 Pb\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Lu", "Ni", "Pb" ], "chemical_system": "Cu-Lu-Ni-Pb", "density": 11.47036153229127, "density_atomic": 0.05477815645433408, "volume": 73.02180757643073, "volume_molar": 10.993690094372507, "formula_full": "Lu1 Cu1 Ni1 Pb1", "formula_reduced": "LuCuNiPb", "formula_anonymous": "ABCD", "formation_energy": -0.03230480625, "spacegroup": 216 }, { "id": "oqmd-1001231", "created_at": "2022-09-04T15:26:26.658362Z", "updated_at": "2022-09-04T15:26:26.658389Z", "structure_string": "Lu1 Ti1 Cu1 Ni1\n1.0\n0.000000 3.133126 3.133126\n3.133126 0.000000 3.133126\n3.133126 3.133126 0.000000\nCu Lu Ni Ti\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.250000 0.250000 0.250000 Lu\n0.500001 0.500001 0.500001 Ni\n0.000000 0.000000 0.000000 Ti\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Lu", "Ni", "Ti" ], "chemical_system": "Cu-Lu-Ni-Ti", "density": 9.315303369924822, "density_atomic": 0.06502740360187242, "volume": 61.51252823332504, "volume_molar": 9.260927588113939, "formula_full": "Lu1 Ti1 Cu1 Ni1", "formula_reduced": "LuTiCuNi", "formula_anonymous": "ABCD", "formation_energy": -0.0183089996965666, "spacegroup": 216 }, { "id": "oqmd-1001232", "created_at": "2022-09-04T15:26:27.610828Z", "updated_at": "2022-09-04T15:26:27.610855Z", "structure_string": "Lu1 Ti1 Cu1 Ni1\n1.0\n0.000000 3.191084 3.191084\n3.191084 0.000000 3.191084\n3.191084 3.191084 0.000000\nCu Lu Ni Ti\n1 1 1 1\ndirect\n0.749999 0.749999 0.749999 Cu\n0.499999 0.499999 0.499999 Lu\n0.250000 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 Ti\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Lu", "Ni", "Ti" ], "chemical_system": "Cu-Lu-Ni-Ti", "density": 8.816899195557385, "density_atomic": 0.061548190084459, "volume": 64.98972584751937, "volume_molar": 9.784431925189297, "formula_full": "Lu1 Ti1 Cu1 Ni1", "formula_reduced": "LuTiCuNi", "formula_anonymous": "ABCD", "formation_energy": -0.208993699696567, "spacegroup": 216 }, { "id": "oqmd-1001233", "created_at": "2022-09-04T15:26:27.632551Z", "updated_at": "2022-09-04T15:26:27.632568Z", "structure_string": "Lu1 Ti1 Cu1 Ni1\n1.0\n0.000000 3.134682 3.134682\n3.134682 0.000000 3.134682\n3.134682 3.134682 0.000000\nCu Lu Ni Ti\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Ni\n0.250000 0.250000 0.250000 Ti\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Lu", "Ni", "Ti" ], "chemical_system": "Cu-Lu-Ni-Ti", "density": 9.301438405279349, "density_atomic": 0.06493061634587842, "volume": 61.60422039877813, "volume_molar": 9.274732166287633, "formula_full": "Lu1 Ti1 Cu1 Ni1", "formula_reduced": "LuTiCuNi", "formula_anonymous": "ABCD", "formation_energy": -0.0550007496965668, "spacegroup": 216 }, { "id": "oqmd-1001234", "created_at": "2022-09-04T15:26:26.735687Z", "updated_at": "2022-09-04T15:26:26.735720Z", "structure_string": "Lu1 Cu1 Si1 Ni1\n1.0\n0.000000 3.110595 3.110595\n3.110595 0.000000 3.110595\n3.110595 3.110595 0.000000\nCu Lu Ni Si\n1 1 1 1\ndirect\n0.750000 0.750000 0.750000 Cu\n0.000000 0.000000 0.000000 Lu\n0.500001 0.500001 0.500001 Ni\n0.249999 0.249999 0.249999 Si\n", "nsites": 4, "nelements": 4, "elements": [ "Cu", "Lu", "Ni", "Si" ], "chemical_system": "Cu-Lu-Ni-Si", "density": 8.973501551854591, "density_atomic": 0.06645070408949222, "volume": 60.19499800352779, "volume_molar": 9.062568775629083, "formula_full": "Lu1 Cu1 Si1 Ni1", "formula_reduced": "LuCuSiNi", "formula_anonymous": "ABCD", "formation_energy": -0.283805345, "spacegroup": 216 } ] }{ "count": 1013513, "next": "