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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1056",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1054",
"results": [
{
"id": "jvasp-119187",
"created_at": "2022-09-04T14:38:52.734938Z",
"updated_at": "2022-09-04T14:38:52.734967Z",
"structure_string": "Ga1 Sb3 Pb4 O13\n1.0\n6.487679 -0.004323 3.649162\n2.132247 6.127277 3.649162\n-0.006085 -0.004323 7.443542\nGa Sb Pb O\n1 3 4 13\ndirect\n0.499489 0.499490 0.499489 Ga\n0.001050 0.499789 0.499788 Sb\n0.499789 0.499789 0.001050 Sb\n0.499788 0.001050 0.499788 Sb\n0.997330 0.997332 0.997329 Pb\n0.505200 0.998309 0.998307 Pb\n0.998308 0.998309 0.505199 Pb\n0.998308 0.505202 0.998307 Pb\n0.178846 0.573234 0.178846 O\n0.178846 0.178847 0.573233 O\n0.571210 0.571211 0.176993 O\n0.573233 0.178847 0.178846 O\n0.176993 0.571211 0.571210 O\n0.426701 0.426702 0.826077 O\n0.823733 0.424806 0.823733 O\n0.823734 0.823735 0.424804 O\n0.571210 0.176994 0.571210 O\n0.424805 0.823735 0.823733 O\n0.826077 0.426702 0.426701 O\n0.426701 0.826078 0.426701 O\n0.123646 0.123646 0.123646 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Ga",
"Sb",
"Pb",
"O"
],
"chemical_system": "Ga-O-Pb-Sb",
"density": 8.251991402669674,
"density_atomic": 0.07090577069972512,
"volume": 296.1677137525481,
"volume_molar": 8.493160289453488,
"formula_full": "Ga1 Sb3 Pb4 O13",
"formula_reduced": "GaSb3Pb4O13",
"formula_anonymous": "AB3C4D13",
"energy_above_hull": 2.141882352619048,
"spacegroup": 160
},
{
"id": "jvasp-92556",
"created_at": "2022-09-04T14:35:59.728230Z",
"updated_at": "2022-09-04T14:35:59.728255Z",
"structure_string": "Tb1 Si3 Ir1\n1.0\n4.225726 0.000000 -0.000000\n-0.000000 4.225726 0.000000\n-2.112863 -2.112863 4.906717\nTb Si Ir\n1 3 1\ndirect\n0.998421 0.998421 0.996839 Tb\n0.414124 0.414124 0.828247 Si\n0.764435 0.264435 0.528868 Si\n0.264435 0.764435 0.528868 Si\n0.652590 0.652590 0.305179 Ir\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Tb",
"density": 8.251686078770366,
"density_atomic": 0.05706585477988787,
"volume": 87.61806897111767,
"volume_molar": 10.552966889269177,
"formula_full": "Tb1 Si3 Ir1",
"formula_reduced": "TbSi3Ir",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.146483059999999,
"spacegroup": 107
},
{
"id": "jvasp-41023",
"created_at": "2022-09-04T14:37:40.306849Z",
"updated_at": "2022-09-04T14:37:40.306879Z",
"structure_string": "Pm2 Sn1 Pd1\n1.0\n-0.000000 3.728499 3.728499\n3.728499 0.000000 3.728499\n3.728499 3.728499 0.000000\nPm Sn Pd\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Pm\n0.749999 0.749999 0.749999 Sn\n0.249999 0.249999 0.249999 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Sn",
"Pd"
],
"chemical_system": "Pd-Pm-Sn",
"density": 8.251518009812216,
"density_atomic": 0.038585834997718366,
"volume": 103.66498483799886,
"volume_molar": 15.607128264442373,
"formula_full": "Pm2 Sn1 Pd1",
"formula_reduced": "Pm2SnPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1294399375,
"spacegroup": 225
},
{
"id": "jvasp-100020",
"created_at": "2022-09-04T14:36:34.385392Z",
"updated_at": "2022-09-04T14:36:34.385401Z",
"structure_string": "Ce1 Y4 Rh5\n1.0\n3.429851 0.000000 0.000000\n-0.000000 3.429851 0.000000\n0.000000 -0.000000 17.283426\nCe Y Rh\n1 4 5\ndirect\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.202187 Y\n0.000000 0.000000 0.400714 Y\n0.000000 0.000000 0.599287 Y\n0.000000 0.000000 0.797814 Y\n0.500000 0.500000 0.097815 Rh\n0.500000 0.500000 0.300344 Rh\n0.500000 0.500000 0.500000 Rh\n0.500000 0.500000 0.699657 Rh\n0.500000 0.500000 0.902185 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Y",
"Rh"
],
"chemical_system": "Ce-Rh-Y",
"density": 8.25096755863029,
"density_atomic": 0.04918352572120934,
"volume": 203.3201128500577,
"volume_molar": 12.244223389221322,
"formula_full": "Ce1 Y4 Rh5",
"formula_reduced": "CeY4Rh5",
"formula_anonymous": "AB4C5",
"energy_above_hull": 3.30220223,
"spacegroup": 123
},
{
"id": "jvasp-26181",
"created_at": "2022-09-04T14:38:03.227341Z",
"updated_at": "2022-09-04T14:38:03.227362Z",
"structure_string": "Ca2 B5 Os3\n1.0\n3.901008 -0.000014 1.192834\n1.790937 5.217856 1.118203\n0.002498 -0.030504 6.967242\nCa B Os\n2 5 3\ndirect\n0.073545 0.558066 0.760738 Ca\n0.392356 0.441937 0.239265 Ca\n0.735313 0.500001 0.500003 B\n0.475531 0.937688 0.119673 B\n0.532893 0.062318 0.880325 B\n0.374063 0.017406 0.689677 B\n0.081143 0.982589 0.310320 B\n0.010209 0.000004 -0.000003 Os\n0.878701 0.136063 0.597885 Os\n0.612649 0.863937 0.402110 Os\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"B",
"Os"
],
"chemical_system": "B-Ca-Os",
"density": 8.250619942463427,
"density_atomic": 0.07048705373938811,
"volume": 141.87002391918685,
"volume_molar": 8.543612536659102,
"formula_full": "Ca2 B5 Os3",
"formula_reduced": "Ca2B5Os3",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 4.682257875666667,
"spacegroup": 5
},
{
"id": "jvasp-39333",
"created_at": "2022-09-04T14:37:58.156835Z",
"updated_at": "2022-09-04T14:37:58.156861Z",
"structure_string": "H3 Pb1\n1.0\n-1.955852 1.955852 2.765142\n1.955852 -1.955852 2.765142\n1.955852 1.955852 -2.765142\nH Pb\n3 1\ndirect\n0.749999 0.249999 0.500001 H\n0.249999 0.749999 0.500001 H\n0.500000 0.500000 0.000000 H\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"H",
"Pb"
],
"chemical_system": "H-Pb",
"density": 8.250525555105297,
"density_atomic": 0.0945389085860805,
"volume": 42.310621730500316,
"volume_molar": 6.370012992604693,
"formula_full": "H3 Pb1",
"formula_reduced": "H3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 2.182237705,
"spacegroup": 225
},
{
"id": "jvasp-15516",
"created_at": "2022-09-04T14:36:42.835178Z",
"updated_at": "2022-09-04T14:36:42.835197Z",
"structure_string": "Tb1 Co1 C2\n1.0\n3.586739 0.000000 0.000000\n0.000000 3.606697 -1.067129\n0.000000 0.007202 3.761246\nTb Co C\n1 1 2\ndirect\n0.000000 0.003025 0.996975 Tb\n0.500000 0.621056 0.378945 Co\n0.500000 0.158434 0.537515 C\n0.500000 0.462486 0.841567 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Co",
"C"
],
"chemical_system": "C-Co-Tb",
"density": 8.250149371634002,
"density_atomic": 0.08216234847279312,
"volume": 48.68410013042096,
"volume_molar": 7.329562593983234,
"formula_full": "Tb1 Co1 C2",
"formula_reduced": "TbCoC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.081184825,
"spacegroup": 38
},
{
"id": "jvasp-115387",
"created_at": "2022-09-04T14:38:46.140668Z",
"updated_at": "2022-09-04T14:38:46.140685Z",
"structure_string": "Pb2 S1\n1.0\n7.034471 0.489679 0.297615\n-3.283839 -4.640342 1.047511\n1.189800 1.993122 -3.359097\nPb S\n2 1\ndirect\n0.429019 0.492148 0.238743 Pb\n0.003532 0.566863 0.026392 Pb\n0.892593 0.956185 0.971225 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 8.249741780918205,
"density_atomic": 0.03338297935258838,
"volume": 89.86615509401476,
"volume_molar": 18.039554517871597,
"formula_full": "Pb2 S1",
"formula_reduced": "Pb2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6321705466666667,
"spacegroup": 38
},
{
"id": "jvasp-85727",
"created_at": "2022-09-04T14:35:56.900284Z",
"updated_at": "2022-09-04T14:35:56.900292Z",
"structure_string": "Tb1 Ga6 Fe6\n1.0\n4.642578 0.000362 1.932064\n2.277519 6.043075 1.072351\n-0.000092 0.025758 6.546283\nTb Ga Fe\n1 6 6\ndirect\n0.002449 0.996950 0.000243 Tb\n0.684928 0.814468 0.817777 Ga\n0.346563 0.652979 0.656290 Ga\n0.658379 0.340889 0.344213 Ga\n0.002488 0.330972 0.666232 Ga\n0.319969 0.179414 0.182738 Ga\n0.002490 0.662927 0.334256 Ga\n0.502479 0.752872 0.244318 Fe\n0.502477 0.241009 0.756194 Fe\n0.502472 0.996945 0.500252 Fe\n0.502472 0.496939 0.000251 Fe\n0.002474 0.996943 0.500258 Fe\n0.002458 0.496945 0.000251 Fe\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Fe"
],
"chemical_system": "Fe-Ga-Tb",
"density": 8.249661310502558,
"density_atomic": 0.07079080047522471,
"volume": 183.6396807597864,
"volume_molar": 8.506953897360747,
"formula_full": "Tb1 Ga6 Fe6",
"formula_reduced": "Tb(GaFe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 1.810309642307692,
"spacegroup": 71
},
{
"id": "jvasp-75889",
"created_at": "2022-09-04T14:35:56.312502Z",
"updated_at": "2022-09-04T14:35:56.312531Z",
"structure_string": "As1 Ru2 Cl1\n1.0\n0.000000 3.156610 3.156610\n3.156610 0.000000 3.156610\n3.156610 3.156610 0.000000\nAs Ru Cl\n1 2 1\ndirect\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Ru\n0.750000 0.750000 0.750000 Ru\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"As",
"Ru",
"Cl"
],
"chemical_system": "As-Cl-Ru",
"density": 8.249481049386409,
"density_atomic": 0.06358683542276189,
"volume": 62.906102708299564,
"volume_molar": 9.47073512930993,
"formula_full": "As1 Ru2 Cl1",
"formula_reduced": "AsRu2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.040879204375,
"spacegroup": 216
},
{
"id": "jvasp-57264",
"created_at": "2022-09-04T14:38:00.424213Z",
"updated_at": "2022-09-04T14:38:00.424237Z",
"structure_string": "Ge1 Pb3 O5\n1.0\n0.000000 5.293602 0.003191\n5.411685 0.000000 0.000000\n0.000000 -0.080307 -5.440226\nGe Pb O\n1 3 5\ndirect\n0.500000 0.482157 0.000000 Ge\n-0.000000 0.456182 0.500000 Pb\n0.000000 0.990652 0.000000 Pb\n0.500000 0.969283 0.500000 Pb\n0.637279 0.291332 0.770427 O\n0.735706 0.670318 0.142532 O\n0.264293 0.670318 0.857469 O\n0.362720 0.291332 0.229574 O\n-0.000000 0.028429 0.500000 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ge",
"Pb",
"O"
],
"chemical_system": "Ge-O-Pb",
"density": 8.249471890311957,
"density_atomic": 0.057749155417089415,
"volume": 155.84643506901705,
"volume_molar": 10.42810187699801,
"formula_full": "Ge1 Pb3 O5",
"formula_reduced": "GePb3O5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.634322878888889,
"spacegroup": 3
},
{
"id": "jvasp-100412",
"created_at": "2022-09-04T14:36:35.688601Z",
"updated_at": "2022-09-04T14:36:35.688621Z",
"structure_string": "Cr1 Ni1\n1.0\n2.391866 0.007699 3.714934\n1.098260 2.124831 3.714934\n0.012601 0.007699 4.418325\nCr Ni\n1 1\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.499999 Ni\n",
"nsites": 2,
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"elements": [
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"Ni"
],
"chemical_system": "Cr-Ni",
"density": 8.249061296867575,
"density_atomic": 0.08975920622059365,
"volume": 22.281836974858805,
"volume_molar": 6.709217932698616,
"formula_full": "Cr1 Ni1",
"formula_reduced": "CrNi",
"formula_anonymous": "AB",
"energy_above_hull": 2.0038749,
"spacegroup": 166
}
]
}