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=-density&page=1210",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1208",
"results": [
{
"id": "jvasp-66625",
"created_at": "2022-09-04T14:36:09.998236Z",
"updated_at": "2022-09-04T14:36:09.998259Z",
"structure_string": "Ba2 Cr1 W1\n1.0\n0.000000 3.778826 3.778826\n3.778826 0.000000 3.778826\n3.778826 3.778826 -0.000000\nBa Cr W\n2 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Cr\n0.500001 0.500001 0.500001 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"W"
],
"chemical_system": "Ba-Cr-W",
"density": 7.854811033153893,
"density_atomic": 0.03706459945154712,
"volume": 107.9196877664635,
"volume_molar": 16.247688762622328,
"formula_full": "Ba2 Cr1 W1",
"formula_reduced": "Ba2CrW",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.529969835,
"spacegroup": 225
},
{
"id": "jvasp-117858",
"created_at": "2022-09-04T14:38:53.003326Z",
"updated_at": "2022-09-04T14:38:53.003366Z",
"structure_string": "Pb2 Br2\n1.0\n6.065762 -0.075422 -1.430957\n-2.287997 -3.023995 0.721456\n1.894125 -3.787432 -6.779521\nPb Br\n2 2\ndirect\n0.174097 0.376168 0.616685 Pb\n0.674233 0.376481 0.116552 Pb\n0.039502 0.144026 0.251337 Br\n0.539488 0.144151 0.751314 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"Br"
],
"chemical_system": "Br-Pb",
"density": 7.854123439909183,
"density_atomic": 0.0329487829621976,
"volume": 121.40053866600266,
"volume_molar": 18.277278304662264,
"formula_full": "Pb2 Br2",
"formula_reduced": "PbBr",
"formula_anonymous": "AB",
"energy_above_hull": 2.520500000002812e-05,
"spacegroup": 38
},
{
"id": "jvasp-36237",
"created_at": "2022-09-04T14:37:12.917721Z",
"updated_at": "2022-09-04T14:37:12.917749Z",
"structure_string": "Ru1 O2\n1.0\n2.413984 2.413984 0.000000\n2.413984 0.000000 -2.413984\n0.000000 2.413984 -2.413984\nRu O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ru\n0.250000 0.250000 0.250000 O\n0.749999 0.749999 0.749999 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ru",
"O"
],
"chemical_system": "O-Ru",
"density": 7.85402321336945,
"density_atomic": 0.10663213316621972,
"volume": 28.134108461691902,
"volume_molar": 5.647585377113857,
"formula_full": "Ru1 O2",
"formula_reduced": "RuO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.4029025000000006,
"spacegroup": 225
},
{
"id": "jvasp-101645",
"created_at": "2022-09-04T14:36:45.110020Z",
"updated_at": "2022-09-04T14:36:45.110047Z",
"structure_string": "Yb1 Zn2 Ga2\n1.0\n3.913587 -0.011427 -4.740653\n-0.514366 3.879654 -4.740653\n0.010042 0.011427 6.147345\nYb Zn Ga\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.750000 0.250000 0.500001 Zn\n0.249999 0.749999 0.500000 Zn\n0.386457 0.386457 -0.000000 Ga\n0.613542 0.613541 -0.000000 Ga\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"Zn",
"Ga"
],
"chemical_system": "Ga-Yb-Zn",
"density": 7.8539666869930755,
"density_atomic": 0.05334679241532699,
"volume": 93.72634742634418,
"volume_molar": 11.288665142442166,
"formula_full": "Yb1 Zn2 Ga2",
"formula_reduced": "Yb(ZnGa)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-79430",
"created_at": "2022-09-04T14:36:44.164853Z",
"updated_at": "2022-09-04T14:36:44.164883Z",
"structure_string": "Li1 Tm2 In1\n1.0\n0.000011 3.649053 3.649061\n3.649059 0.000007 3.649065\n3.649054 3.649054 0.000010\nLi Tm In\n1 2 1\ndirect\n0.750001 0.750001 0.749999 Li\n0.000000 -0.000000 0.000000 Tm\n0.499999 0.500000 0.499998 Tm\n0.250000 0.249998 0.250000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tm",
"In"
],
"chemical_system": "In-Li-Tm",
"density": 7.853884633444361,
"density_atomic": 0.0411613378433757,
"volume": 97.17857119271792,
"volume_molar": 14.63057586445571,
"formula_full": "Li1 Tm2 In1",
"formula_reduced": "LiTm2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6633921175,
"spacegroup": 225
},
{
"id": "jvasp-34413",
"created_at": "2022-09-04T14:38:34.612157Z",
"updated_at": "2022-09-04T14:38:34.612184Z",
"structure_string": "Ta4 O10\n1.0\n3.698257 0.000000 0.000000\n-0.000000 6.493162 0.000000\n0.000000 0.000000 7.781408\nTa O\n4 10\ndirect\n0.500000 0.500000 0.500000 Ta\n0.500000 0.500000 0.000000 Ta\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 Ta\n0.500000 0.500000 0.750000 O\n-0.000001 0.320315 0.000000 O\n0.000000 0.000000 0.250000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.750000 O\n0.000001 0.679685 0.000000 O\n0.000001 0.320315 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.250000 O\n-0.000001 0.679685 0.500000 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ta",
"O"
],
"chemical_system": "O-Ta",
"density": 7.853883696950045,
"density_atomic": 0.0749232352357008,
"volume": 186.85792139057315,
"volume_molar": 8.037747890964617,
"formula_full": "Ta4 O10",
"formula_reduced": "Ta2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.7660594142857136,
"spacegroup": 47
},
{
"id": "jvasp-36646",
"created_at": "2022-09-04T14:37:27.856632Z",
"updated_at": "2022-09-04T14:37:27.856651Z",
"structure_string": "Lu1 Tl1 Te2\n1.0\n-2.181773 -3.778943 -0.000000\n-4.363547 -0.000000 -0.000000\n-2.181773 -1.259647 -8.136285\nLu Tl Te\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 Tl\n0.763506 0.763505 0.709482 Te\n0.236494 0.236494 0.290518 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Tl",
"Te"
],
"chemical_system": "Lu-Te-Tl",
"density": 7.853784836188351,
"density_atomic": 0.029814246592350196,
"volume": 134.16404763440605,
"volume_molar": 20.198869494643457,
"formula_full": "Lu1 Tl1 Te2",
"formula_reduced": "LuTlTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3696684708333334,
"spacegroup": 166
},
{
"id": "jvasp-15987",
"created_at": "2022-09-04T14:36:11.005129Z",
"updated_at": "2022-09-04T14:36:11.005140Z",
"structure_string": "Hf2 Si2 S2\n1.0\n3.549226 0.000000 -0.000000\n0.000000 3.549226 0.000000\n-0.000000 -0.000000 8.011254\nHf Si S\n2 2 2\ndirect\n0.500000 0.000000 0.730218 Hf\n0.000000 0.500000 0.269782 Hf\n0.500000 0.500000 0.000000 Si\n0.000000 0.000000 0.000000 Si\n0.000000 0.500000 0.620398 S\n0.500000 0.000000 0.379601 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Si",
"S"
],
"chemical_system": "Hf-S-Si",
"density": 7.853358685469705,
"density_atomic": 0.05945432329258145,
"volume": 100.91780828911838,
"volume_molar": 10.12902077846276,
"formula_full": "Hf2 Si2 S2",
"formula_reduced": "HfSiS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.712563866666666,
"spacegroup": 129
},
{
"id": "jvasp-34192",
"created_at": "2022-09-04T14:37:15.018428Z",
"updated_at": "2022-09-04T14:37:15.018458Z",
"structure_string": "Tb4 O6\n1.0\n5.368454 0.000000 0.000000\n0.000000 5.368454 0.000000\n0.000000 -0.000000 5.368205\nTb O\n4 6\ndirect\n0.250000 0.749999 0.749999 Tb\n0.749999 0.749999 0.250000 Tb\n0.250000 0.250000 0.250000 Tb\n0.749999 0.250000 0.749999 Tb\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Tb",
"O"
],
"chemical_system": "O-Tb",
"density": 7.853319784174081,
"density_atomic": 0.06463569685453867,
"volume": 154.71326970458443,
"volume_molar": 9.31705087600851,
"formula_full": "Tb4 O6",
"formula_reduced": "Tb2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.48497146,
"spacegroup": 224
},
{
"id": "jvasp-52132",
"created_at": "2022-09-04T14:37:17.821102Z",
"updated_at": "2022-09-04T14:37:17.821124Z",
"structure_string": "Tb4 O6\n1.0\n5.368454 0.000000 0.000000\n-0.000000 5.368454 -0.000000\n0.000000 -0.000000 5.368205\nTb O\n4 6\ndirect\n0.250000 0.749999 0.749999 Tb\n0.749999 0.749999 0.250000 Tb\n0.250000 0.250000 0.250000 Tb\n0.749999 0.250000 0.749999 Tb\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Tb",
"O"
],
"chemical_system": "O-Tb",
"density": 7.853319784174081,
"density_atomic": 0.06463569685453867,
"volume": 154.71326970458443,
"volume_molar": 9.31705087600851,
"formula_full": "Tb4 O6",
"formula_reduced": "Tb2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.48497146,
"spacegroup": 224
},
{
"id": "jvasp-13020",
"created_at": "2022-09-04T14:36:36.357904Z",
"updated_at": "2022-09-04T14:36:36.357926Z",
"structure_string": "Cu4 Pb2 O4\n1.0\n5.161516 -0.046815 -2.807310\n-1.617962 4.901596 -2.807310\n0.022132 0.030321 6.105979\nCu Pb O\n4 2 4\ndirect\n0.500001 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n-0.000000 -0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.377621 0.622381 0.250001 Pb\n0.622380 0.377621 0.750001 Pb\n0.006193 0.646580 0.290877 O\n0.353422 0.993809 0.209124 O\n0.993809 0.353422 0.709124 O\n0.646580 0.006193 0.790877 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cu",
"Pb",
"O"
],
"chemical_system": "Cu-O-Pb",
"density": 7.853263335883544,
"density_atomic": 0.06455725512404553,
"volume": 154.90125750831865,
"volume_molar": 9.328371766161016,
"formula_full": "Cu4 Pb2 O4",
"formula_reduced": "Cu2PbO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7338937439999995,
"spacegroup": 15
},
{
"id": "jvasp-27208",
"created_at": "2022-09-04T14:38:32.396587Z",
"updated_at": "2022-09-04T14:38:32.396608Z",
"structure_string": "Ba2 U1 Fe1 O6\n1.0\n5.053656 -0.000000 2.917730\n1.684552 4.764633 2.917730\n-0.000000 -0.000000 5.835459\nBa U Fe O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 U\n0.000000 0.000000 0.000000 Fe\n0.758606 0.241394 0.241394 O\n0.758606 0.758605 0.241394 O\n0.241394 0.241394 0.758606 O\n0.758606 0.241394 0.758606 O\n0.241394 0.758605 0.241395 O\n0.241394 0.758605 0.758606 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"U",
"Fe",
"O"
],
"chemical_system": "Ba-Fe-O-U",
"density": 7.853257140641185,
"density_atomic": 0.07116883344984012,
"volume": 140.5109444016391,
"volume_molar": 8.46176685507205,
"formula_full": "Ba2 U1 Fe1 O6",
"formula_reduced": "Ba2UFeO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.511394444,
"spacegroup": 225
}
]
}