HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=418",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=416",
"results": [
{
"id": "jvasp-107194",
"created_at": "2022-09-04T14:36:58.197101Z",
"updated_at": "2022-09-04T14:36:58.197110Z",
"structure_string": "Mg2 Ag4\n1.0\n5.109375 -0.016103 0.000000\n-2.692290 4.342528 0.000000\n-0.000000 -0.000000 4.843288\nMg Ag\n2 4\ndirect\n0.795231 0.795231 0.750000 Mg\n0.204771 0.204770 0.250000 Mg\n0.531369 0.860881 0.250000 Ag\n0.139120 0.468632 0.750000 Ag\n0.468633 0.139120 0.750000 Ag\n0.860881 0.531369 0.250000 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ag"
],
"chemical_system": "Ag-Mg",
"density": 7.43299725996653,
"density_atomic": 0.055943544468181415,
"volume": 107.25098055616719,
"volume_molar": 10.764675025954364,
"formula_full": "Mg2 Ag4",
"formula_reduced": "MgAg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0521083333333333,
"spacegroup": 63
},
{
"id": "jvasp-107195",
"created_at": "2022-09-04T14:36:58.838261Z",
"updated_at": "2022-09-04T14:36:58.838286Z",
"structure_string": "Mg2 Co6\n1.0\n5.196085 0.000000 0.000000\n-2.598043 4.499942 0.000000\n0.000000 -0.000000 4.165424\nMg Co\n2 6\ndirect\n0.666667 0.333333 0.250000 Mg\n0.333334 0.666666 0.749999 Mg\n0.158615 0.317230 0.250000 Co\n0.682771 0.841385 0.250000 Co\n0.158615 0.841385 0.250000 Co\n0.841386 0.158615 0.749999 Co\n0.317230 0.158615 0.749999 Co\n0.841386 0.682770 0.749999 Co\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Co"
],
"chemical_system": "Co-Mg",
"density": 6.857387435369555,
"density_atomic": 0.08213865913782509,
"volume": 97.39628189664441,
"volume_molar": 7.331676488527905,
"formula_full": "Mg2 Co6",
"formula_reduced": "MgCo3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.386305285714286,
"spacegroup": 194
},
{
"id": "jvasp-107197",
"created_at": "2022-09-04T14:36:59.470249Z",
"updated_at": "2022-09-04T14:36:59.470272Z",
"structure_string": "Mg1 Pt5\n1.0\n4.884514 0.000000 0.000000\n-2.442257 4.230113 0.000000\n-0.000000 -0.000000 4.593661\nMg Pt\n1 5\ndirect\n0.000000 0.000000 0.000000 Mg\n0.660809 -0.000000 0.500000 Pt\n0.666666 0.333333 -0.000000 Pt\n0.339190 0.339190 0.500000 Pt\n-0.000001 0.660809 0.500000 Pt\n0.333332 0.666666 -0.000000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Pt"
],
"chemical_system": "Mg-Pt",
"density": 17.490304889960715,
"density_atomic": 0.06321483088993027,
"volume": 94.91443567170506,
"volume_molar": 9.526468196182885,
"formula_full": "Mg1 Pt5",
"formula_reduced": "MgPt5",
"formula_anonymous": "AB5",
"energy_above_hull": 2.28223612,
"spacegroup": 189
},
{
"id": "jvasp-107198",
"created_at": "2022-09-04T14:36:59.680296Z",
"updated_at": "2022-09-04T14:36:59.680322Z",
"structure_string": "Mg1 Sc1 Ir2\n1.0\n3.881104 -0.000000 2.240756\n1.293701 3.659140 2.240756\n-0.000000 -0.000000 4.481513\nMg Sc Ir\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Ir\n0.749999 0.750000 0.750001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Ir"
],
"chemical_system": "Ir-Mg-Sc",
"density": 11.837337746962193,
"density_atomic": 0.06284938382602143,
"volume": 63.64421982358221,
"volume_molar": 9.58186125844986,
"formula_full": "Mg1 Sc1 Ir2",
"formula_reduced": "MgScIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.540704125,
"spacegroup": 225
},
{
"id": "jvasp-107199",
"created_at": "2022-09-04T14:36:56.058279Z",
"updated_at": "2022-09-04T14:36:56.058288Z",
"structure_string": "Mg1 Sc3\n1.0\n4.944505 -0.002504 -3.614214\n-0.445062 3.095866 -5.265759\n0.009897 0.002504 6.124588\nMg Sc\n1 3\ndirect\n0.169065 0.500000 0.669065 Mg\n0.757967 0.753993 0.003978 Sc\n0.249986 0.246010 0.003976 Sc\n0.656367 -0.000000 0.656367 Sc\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Sc"
],
"chemical_system": "Mg-Sc",
"density": 2.8140643822637834,
"density_atomic": 0.04258692097508802,
"volume": 93.92555057783754,
"volume_molar": 14.140822163505927,
"formula_full": "Mg1 Sc3",
"formula_reduced": "MgSc3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.831152675,
"spacegroup": 44
},
{
"id": "jvasp-10720",
"created_at": "2022-09-04T14:37:58.176977Z",
"updated_at": "2022-09-04T14:37:58.177006Z",
"structure_string": "Li4 Er4 O8\n1.0\n0.000000 6.099003 -0.004658\n6.105373 0.000000 0.000000\n0.000000 -2.993663 -5.414380\nLi Er O\n4 4 8\ndirect\n0.708559 0.344384 0.935876 Li\n0.291441 0.844384 0.564124 Li\n0.291441 0.655615 0.064124 Li\n0.708559 0.155615 0.435876 Li\n0.766349 0.869217 0.021549 Er\n0.766349 0.630782 0.521549 Er\n0.233651 0.130782 0.978451 Er\n0.233651 0.369218 0.478451 Er\n0.012612 0.672037 0.343951 O\n0.545912 0.607739 0.738162 O\n0.987388 0.172037 0.156049 O\n0.987388 0.327963 0.656049 O\n0.454088 0.392260 0.261838 O\n0.454088 0.107740 0.761838 O\n0.545912 0.892260 0.238162 O\n0.012612 0.827963 0.843951 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Er",
"O"
],
"chemical_system": "Er-Li-O",
"density": 6.790348874268571,
"density_atomic": 0.07932623612646521,
"volume": 201.6987163552312,
"volume_molar": 7.5916128812657275,
"formula_full": "Li4 Er4 O8",
"formula_reduced": "LiErO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9160792499999996,
"spacegroup": 14
},
{
"id": "jvasp-107200",
"created_at": "2022-09-04T14:36:56.684850Z",
"updated_at": "2022-09-04T14:36:56.684874Z",
"structure_string": "Mn2 Ir1 Rh1\n1.0\n3.712013 -0.000000 2.143132\n1.237338 3.499719 2.143132\n-0.000000 -0.000000 4.286263\nMn Ir Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Mn\n0.750000 0.750000 0.749999 Mn\n0.500000 0.500000 0.499999 Ir\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"Rh"
],
"chemical_system": "Ir-Mn-Rh",
"density": 12.077613557594779,
"density_atomic": 0.07183539963816182,
"volume": 55.68285302438884,
"volume_molar": 8.383249470781532,
"formula_full": "Mn2 Ir1 Rh1",
"formula_reduced": "Mn2IrRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.967314645689655,
"spacegroup": 225
},
{
"id": "jvasp-107201",
"created_at": "2022-09-04T14:37:00.435383Z",
"updated_at": "2022-09-04T14:37:00.435393Z",
"structure_string": "Mn1 Ga1 Pd2\n1.0\n3.784733 0.000000 2.185117\n1.261578 3.568281 2.185117\n-0.000000 -0.000000 4.370234\nMn Ga Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Ga\n0.750000 0.750000 0.750001 Pd\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Ga",
"Pd"
],
"chemical_system": "Ga-Mn-Pd",
"density": 9.49566169458123,
"density_atomic": 0.06777367027574087,
"volume": 59.01997019972184,
"volume_molar": 8.885664204843255,
"formula_full": "Mn1 Ga1 Pd2",
"formula_reduced": "MnGaPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6808452415948274,
"spacegroup": 225
},
{
"id": "jvasp-107202",
"created_at": "2022-09-04T14:36:57.339074Z",
"updated_at": "2022-09-04T14:36:57.339101Z",
"structure_string": "Na8\n1.0\n6.625569 -0.000000 0.000000\n0.000000 6.625569 0.000000\n-0.000000 0.000000 6.625569\nNa\n8\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.250000 -0.000000 Na\n0.500000 0.750000 -0.000000 Na\n-0.000000 0.500000 0.250000 Na\n0.250000 0.000000 0.500000 Na\n0.750000 0.000000 0.500000 Na\n0.500000 0.500000 0.500000 Na\n-0.000000 0.500000 0.750000 Na\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Na"
],
"chemical_system": "Na",
"density": 1.0500359150297442,
"density_atomic": 0.027505556965510238,
"volume": 290.85031835680905,
"volume_molar": 21.89426946544395,
"formula_full": "Na8",
"formula_reduced": "Na",
"formula_anonymous": "A",
"energy_above_hull": 0.0022299999999999,
"spacegroup": 223
},
{
"id": "jvasp-107203",
"created_at": "2022-09-04T14:37:01.690576Z",
"updated_at": "2022-09-04T14:37:01.690594Z",
"structure_string": "Na3 Pd1\n1.0\n4.178878 -0.427447 -2.796593\n-1.426599 3.951018 -2.796593\n0.333881 0.427447 5.017218\nNa Pd\n3 1\ndirect\n0.750000 0.250000 0.500001 Na\n0.250000 0.750000 0.500001 Na\n0.500000 0.500000 0.000001 Na\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Pd"
],
"chemical_system": "Na-Pd",
"density": 3.21571486854386,
"density_atomic": 0.044165719855065746,
"volume": 90.5679792637005,
"volume_molar": 13.63532798686914,
"formula_full": "Na3 Pd1",
"formula_reduced": "Na3Pd",
"formula_anonymous": "AB3",
"energy_above_hull": 2.500000000000072e-05,
"spacegroup": 225
},
{
"id": "jvasp-107204",
"created_at": "2022-09-04T14:37:01.873294Z",
"updated_at": "2022-09-04T14:37:01.873317Z",
"structure_string": "Na1 Ga3\n1.0\n4.298478 0.000000 0.000000\n0.000000 4.298478 0.000000\n-0.000000 0.000000 4.298478\nNa Ga\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n-0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.500000 -0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Ga"
],
"chemical_system": "Ga-Na",
"density": 4.85389151212413,
"density_atomic": 0.05036349567244278,
"volume": 79.42260453911793,
"volume_molar": 11.957352601509577,
"formula_full": "Na1 Ga3",
"formula_reduced": "NaGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0415563636363636,
"spacegroup": 221
},
{
"id": "jvasp-107205",
"created_at": "2022-09-04T14:37:16.415067Z",
"updated_at": "2022-09-04T14:37:16.415093Z",
"structure_string": "Nb2 Rh6\n1.0\n5.550308 0.000000 0.000000\n-2.775154 4.806708 0.000000\n0.000000 -0.000000 4.442283\nNb Rh\n2 6\ndirect\n0.666667 0.333333 0.250000 Nb\n0.333334 0.666667 0.749999 Nb\n0.835819 0.164182 0.749999 Rh\n0.328365 0.164182 0.749999 Rh\n0.835819 0.671636 0.749999 Rh\n0.164183 0.835818 0.250000 Rh\n0.671636 0.835818 0.250000 Rh\n0.164182 0.328365 0.250000 Rh\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nb",
"Rh"
],
"chemical_system": "Nb-Rh",
"density": 11.254507448290608,
"density_atomic": 0.06750235749666102,
"volume": 118.5143792999484,
"volume_molar": 8.921378427853995,
"formula_full": "Nb2 Rh6",
"formula_reduced": "NbRh3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.4085296,
"spacegroup": 194
}
]
}