Oqmd Structure
GET /third-parties/OqmdStructure/?format=api&ordering=-id&page=364
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"spacegroup": 216 }, { "id": "oqmd-995696", "created_at": "2022-09-04T15:25:54.386418Z", "updated_at": "2022-09-04T15:25:54.386451Z", "structure_string": "Li1 Ca1 Bi1 Pd1\n1.0\n0.000000 3.465462 3.465462\n3.465462 0.000000 3.465462\n3.465462 3.465462 0.000000\nBi Ca Li Pd\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.000000 Ca\n0.750000 0.750000 0.750000 Li\n0.250000 0.250000 0.250000 Pd\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Ca", "Li", "Pd" ], "chemical_system": "Bi-Ca-Li-Pd", "density": 7.230146808959813, "density_atomic": 0.04805588422040062, "volume": 83.23642494339799, "volume_molar": 12.531536684207943, "formula_full": "Li1 Ca1 Bi1 Pd1", "formula_reduced": "LiCaBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.67312420625, "spacegroup": 216 }, { "id": "oqmd-995695", "created_at": "2022-09-04T15:25:54.905508Z", "updated_at": "2022-09-04T15:25:54.905528Z", "structure_string": "Li1 Ca1 Bi1 Pd1\n1.0\n0.000000 3.493006 3.493006\n3.493006 0.000000 3.493006\n3.493006 3.493006 0.000000\nBi Ca Li Pd\n1 1 1 1\ndirect\n0.250001 0.250001 0.250001 Bi\n0.000000 0.000000 0.000000 Ca\n0.750000 0.750000 0.750000 Li\n0.499999 0.499999 0.499999 Pd\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Ca", "Li", "Pd" ], "chemical_system": "Bi-Ca-Li-Pd", "density": 7.060452635447498, "density_atomic": 0.04692799515111108, "volume": 85.23696755251848, "volume_molar": 12.832725413920475, "formula_full": "Li1 Ca1 Bi1 Pd1", "formula_reduced": "LiCaBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.56259682125, "spacegroup": 216 }, { "id": "oqmd-995694", "created_at": "2022-09-04T15:25:54.602978Z", "updated_at": "2022-09-04T15:25:54.603000Z", "structure_string": "Li1 Zn1 Bi1 Pd1\n1.0\n0.000000 3.304210 3.304210\n3.304210 0.000000 3.304210\n3.304210 3.304210 0.000000\nBi Li Pd Zn\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Bi\n0.750001 0.750001 0.750001 Li\n0.500000 0.500000 0.500000 Pd\n0.250001 0.250001 0.250001 Zn\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Pd", "Zn" ], "chemical_system": "Bi-Li-Pd-Zn", "density": 8.924182285300644, "density_atomic": 0.05544049152088692, "volume": 72.14943248641691, "volume_molar": 10.862350954682986, "formula_full": "Li1 Zn1 Bi1 Pd1", "formula_reduced": "LiZnBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.25623904875, "spacegroup": 216 }, { "id": "oqmd-995693", "created_at": "2022-09-04T15:25:54.342654Z", "updated_at": "2022-09-04T15:25:54.342686Z", "structure_string": "Li1 Zn1 Bi1 Pd1\n1.0\n0.000000 3.300607 3.300607\n3.300607 0.000000 3.300607\n3.300607 3.300607 0.000000\nBi Li Pd Zn\n1 1 1 1\ndirect\n0.499999 0.499999 0.499999 Bi\n0.750000 0.750000 0.750000 Li\n0.249999 0.249999 0.249999 Pd\n0.000000 0.000000 0.000000 Zn\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Pd", "Zn" ], "chemical_system": "Bi-Li-Pd-Zn", "density": 8.9534395775724, "density_atomic": 0.05562224920044353, "volume": 71.91366867573748, "volume_molar": 10.82685588333235, "formula_full": "Li1 Zn1 Bi1 Pd1", "formula_reduced": "LiZnBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.32013286875, "spacegroup": 216 }, { "id": "oqmd-995692", "created_at": "2022-09-04T15:25:54.815652Z", "updated_at": "2022-09-04T15:25:54.815674Z", "structure_string": "Li1 Zn1 Bi1 Pd1\n1.0\n0.000000 3.340296 3.340296\n3.340296 0.000000 3.340296\n3.340296 3.340296 0.000000\nBi Li Pd Zn\n1 1 1 1\ndirect\n0.250000 0.250000 0.250000 Bi\n0.750001 0.750001 0.750001 Li\n0.500001 0.500001 0.500001 Pd\n0.000000 0.000000 0.000000 Zn\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Pd", "Zn" ], "chemical_system": "Bi-Li-Pd-Zn", "density": 8.638065559809784, "density_atomic": 0.05366302313370622, "volume": 74.53922210147651, "volume_molar": 11.222142190899865, "formula_full": "Li1 Zn1 Bi1 Pd1", "formula_reduced": "LiZnBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.23832233375, "spacegroup": 216 }, { "id": "oqmd-995691", "created_at": "2022-09-04T15:25:54.157742Z", "updated_at": "2022-09-04T15:25:54.157769Z", "structure_string": "Sr1 Li1 Bi1 Pd1\n1.0\n0.000000 3.685684 3.685684\n3.685684 0.000000 3.685684\n3.685684 3.685684 0.000000\nBi Li Pd Sr\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Bi\n0.750001 0.750001 0.750001 Li\n0.499999 0.499999 0.499999 Pd\n0.250000 0.250000 0.250000 Sr\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Pd", "Sr" ], "chemical_system": "Bi-Li-Pd-Sr", "density": 6.798416650672756, "density_atomic": 0.03994622130730106, "volume": 100.1346277343362, "volume_molar": 15.075620579159311, "formula_full": "Sr1 Li1 Bi1 Pd1", "formula_reduced": "SrLiBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.41628606125, "spacegroup": 216 }, { "id": "oqmd-995690", "created_at": "2022-09-04T15:25:54.764314Z", "updated_at": "2022-09-04T15:25:54.764351Z", "structure_string": "Sr1 Li1 Bi1 Pd1\n1.0\n0.000000 3.573285 3.573285\n3.573285 0.000000 3.573285\n3.573285 3.573285 0.000000\nBi Li Pd Sr\n1 1 1 1\ndirect\n0.499999 0.499999 0.499999 Bi\n0.749999 0.749999 0.749999 Li\n0.250000 0.250000 0.250000 Pd\n0.000000 0.000000 0.000000 Sr\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Pd", "Sr" ], "chemical_system": "Bi-Li-Pd-Sr", "density": 7.460348244106601, "density_atomic": 0.04383560721585466, "volume": 91.25001919793783, "volume_molar": 13.738011499067099, "formula_full": "Sr1 Li1 Bi1 Pd1", "formula_reduced": "SrLiBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.61161679625, "spacegroup": 216 }, { "id": "oqmd-995689", "created_at": "2022-09-04T15:25:08.670306Z", "updated_at": "2022-09-04T15:25:08.670324Z", "structure_string": "Sr1 Li1 Bi1 Pd1\n1.0\n0.000000 3.609853 3.609853\n3.609853 0.000000 3.609853\n3.609853 3.609853 0.000000\nBi Li Pd Sr\n1 1 1 1\ndirect\n0.250000 0.250000 0.250000 Bi\n0.750000 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Sr\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Pd", "Sr" ], "chemical_system": "Bi-Li-Pd-Sr", "density": 7.235916030451261, "density_atomic": 0.04251688561701348, "volume": 94.08026815584459, "volume_molar": 14.164115439326045, "formula_full": "Sr1 Li1 Bi1 Pd1", "formula_reduced": "SrLiBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.47743422875, "spacegroup": 216 }, { "id": "oqmd-995688", "created_at": "2022-09-04T15:25:54.676901Z", "updated_at": "2022-09-04T15:25:54.676928Z", "structure_string": "Li1 Mg1 Bi1 Pd1\n1.0\n0.000000 3.369388 3.369388\n3.369388 0.000000 3.369388\n3.369388 3.369388 0.000000\nBi Li Mg Pd\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Bi\n0.750000 0.750000 0.750000 Li\n0.249999 0.249999 0.249999 Mg\n0.500000 0.500000 0.500000 Pd\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Mg", "Pd" ], "chemical_system": "Bi-Li-Mg-Pd", "density": 7.5240681699533125, "density_atomic": 0.052284976994370014, "volume": 76.50381103602122, "volume_molar": 11.51791796838403, "formula_full": "Li1 Mg1 Bi1 Pd1", "formula_reduced": "LiMgBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.400633086041668, "spacegroup": 216 }, { "id": "oqmd-995687", "created_at": "2022-09-04T15:25:54.322018Z", "updated_at": "2022-09-04T15:25:54.322039Z", "structure_string": "Li1 Mg1 Bi1 Pd1\n1.0\n0.000000 3.357192 3.357192\n3.357192 0.000000 3.357192\n3.357192 3.357192 0.000000\nBi Li Mg Pd\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 Bi\n0.750000 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Mg\n0.249999 0.249999 0.249999 Pd\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Mg", "Pd" ], "chemical_system": "Bi-Li-Mg-Pd", "density": 7.606366677860533, "density_atomic": 0.05285687181182842, "volume": 75.67606373377684, "volume_molar": 11.393297699188382, "formula_full": "Li1 Mg1 Bi1 Pd1", "formula_reduced": "LiMgBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.469011826041668, "spacegroup": 216 }, { "id": "oqmd-995686", "created_at": "2022-09-04T15:25:54.259118Z", "updated_at": "2022-09-04T15:25:54.259143Z", "structure_string": "Li1 Mg1 Bi1 Pd1\n1.0\n0.000000 3.391628 3.391628\n3.391628 0.000000 3.391628\n3.391628 3.391628 0.000000\nBi Li Mg Pd\n1 1 1 1\ndirect\n0.249999 0.249999 0.249999 Bi\n0.750000 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Pd\n", "nsites": 4, "nelements": 4, "elements": [ "Bi", "Li", "Mg", "Pd" ], "chemical_system": "Bi-Li-Mg-Pd", "density": 7.37702338522409, "density_atomic": 0.05126315834346893, "volume": 78.0287467502402, "volume_molar": 11.747502406408477, "formula_full": "Li1 Mg1 Bi1 Pd1", "formula_reduced": "LiMgBiPd", "formula_anonymous": "ABCD", "formation_energy": -0.357795931041667, "spacegroup": 216 } ] }