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=-created_at&page=315",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=313",
"results": [
{
"id": "jvasp-115542",
"created_at": "2022-09-04T14:38:46.163471Z",
"updated_at": "2022-09-04T14:38:46.163498Z",
"structure_string": "Ba1 H1 Br1\n1.0\n4.541789 -0.808915 0.000000\n-1.285034 5.933388 0.000000\n0.000000 0.000000 5.324508\nBa H Br\n1 1 1\ndirect\n0.390405 -0.026991 0.000000 Ba\n-0.186447 -0.180755 0.000000 H\n0.098667 0.389631 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"H",
"Br"
],
"chemical_system": "Ba-Br-H",
"density": 2.6269754594464656,
"density_atomic": 0.021746828492641156,
"volume": 137.9511500270102,
"volume_molar": 27.69204144888444,
"formula_full": "Ba1 H1 Br1",
"formula_reduced": "BaHBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3411200249999999,
"spacegroup": 38
},
{
"id": "jvasp-113014",
"created_at": "2022-09-04T14:38:46.163100Z",
"updated_at": "2022-09-04T14:38:46.163124Z",
"structure_string": "La3 Hf1 Ga5 O14\n1.0\n8.327163 -0.000000 0.000000\n-4.163581 7.211535 0.000000\n-0.000000 -0.000000 5.193244\nLa Hf Ga O\n3 1 5 14\ndirect\n0.573531 0.000000 -0.000000 La\n-0.000000 0.573531 -0.000000 La\n0.426469 0.426469 -0.000000 La\n0.000000 0.000000 0.000000 Hf\n0.333333 0.666666 0.530544 Ga\n0.666666 0.333333 0.469455 Ga\n0.245285 0.000000 0.500000 Ga\n-0.000000 0.245285 0.500000 Ga\n0.754715 0.754715 0.500000 Ga\n0.687729 0.541650 0.299479 O\n0.146079 0.458349 0.700520 O\n0.853920 0.312270 0.299479 O\n0.458349 0.146079 0.299479 O\n0.666666 0.333333 0.820618 O\n0.333333 0.666666 0.179381 O\n0.227671 0.146980 0.757853 O\n0.919308 0.772328 0.757853 O\n0.080692 0.853020 0.242146 O\n0.312270 0.853920 0.700520 O\n0.772328 0.919308 0.242146 O\n0.146980 0.227671 0.242146 O\n0.853020 0.080692 0.757853 O\n0.541650 0.687729 0.700520 O\n",
"nsites": 23,
"nelements": 4,
"elements": [
"La",
"Hf",
"Ga",
"O"
],
"chemical_system": "Ga-Hf-La-O",
"density": 6.218117110361126,
"density_atomic": 0.07375039089649257,
"volume": 311.8627538161813,
"volume_molar": 8.165571309922917,
"formula_full": "La3 Hf1 Ga5 O14",
"formula_reduced": "La3HfGa5O14",
"formula_anonymous": "AB3C5D14",
"energy_above_hull": 2.238657766304348,
"spacegroup": 150
},
{
"id": "jvasp-110793",
"created_at": "2022-09-04T14:38:46.150675Z",
"updated_at": "2022-09-04T14:38:46.150705Z",
"structure_string": "In1\n1.0\n3.116518 -0.000000 -1.101856\n-1.558259 2.698984 -1.101856\n-0.000000 -0.000000 3.305567\nIn\n1\ndirect\n0.000000 0.000000 0.000000 In\n",
"nsites": 1,
"nelements": 1,
"elements": [
"In"
],
"chemical_system": "In",
"density": 6.857142288300161,
"density_atomic": 0.03596533303642515,
"volume": 27.8045527616056,
"volume_molar": 16.744293049923563,
"formula_full": "In1",
"formula_reduced": "In",
"formula_anonymous": "A",
"energy_above_hull": 0.00551,
"spacegroup": 229
},
{
"id": "jvasp-115540",
"created_at": "2022-09-04T14:38:46.148328Z",
"updated_at": "2022-09-04T14:38:46.148364Z",
"structure_string": "Ba1 H1 Br2\n1.0\n4.685715 0.000000 0.000000\n0.000000 4.685715 0.000000\n-0.000000 0.000000 6.199613\nBa H Br\n1 1 2\ndirect\n0.500001 0.500001 0.502429 Ba\n0.000000 0.000000 0.002414 H\n0.000000 0.000000 0.502728 Br\n0.500001 0.500001 0.002427 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"H",
"Br"
],
"chemical_system": "Ba-Br-H",
"density": 3.6371172958691083,
"density_atomic": 0.029386216321504885,
"volume": 136.1182384365963,
"volume_molar": 20.49307979671063,
"formula_full": "Ba1 H1 Br2",
"formula_reduced": "BaHBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.286988545,
"spacegroup": 123
},
{
"id": "jvasp-115337",
"created_at": "2022-09-04T14:38:46.148211Z",
"updated_at": "2022-09-04T14:38:46.148227Z",
"structure_string": "Ta1 Sn1 O1\n1.0\n6.604132 -0.000000 0.000000\n-0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nTa Sn O\n1 1 1\ndirect\n-0.098241 -0.030424 0.000000 Ta\n-0.000566 0.348889 0.000000 Sn\n0.313865 -0.000606 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Sn",
"O"
],
"chemical_system": "O-Sn-Ta",
"density": 2.5234213048401912,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Ta1 Sn1 O1",
"formula_reduced": "TaSnO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.7115448,
"spacegroup": 6
},
{
"id": "jvasp-115398",
"created_at": "2022-09-04T14:38:46.145605Z",
"updated_at": "2022-09-04T14:38:46.145631Z",
"structure_string": "Pd1 F2\n1.0\n3.241059 0.000000 0.000000\n0.000000 2.803658 0.000000\n0.000000 0.000000 4.719368\nPd F\n1 2\ndirect\n0.466669 0.000000 0.000000 Pd\n-0.033335 0.000000 0.743509 F\n-0.033335 0.000000 0.256493 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pd",
"F"
],
"chemical_system": "F-Pd",
"density": 5.592049642853617,
"density_atomic": 0.06995607562017786,
"volume": 42.88405221997175,
"volume_molar": 8.608459960928677,
"formula_full": "Pd1 F2",
"formula_reduced": "PdF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0897839666666665,
"spacegroup": 47
},
{
"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-115330",
"created_at": "2022-09-04T14:38:46.140358Z",
"updated_at": "2022-09-04T14:38:46.140386Z",
"structure_string": "Sr1 Sn1 O1\n1.0\n5.046304 0.000000 0.000000\n-2.523152 4.370228 -0.000000\n-0.000000 0.000000 3.687881\nSr Sn O\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Sr\n0.333333 0.666667 0.000000 Sn\n0.000000 0.000000 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Sn",
"O"
],
"chemical_system": "O-Sn-Sr",
"density": 4.539328258118211,
"density_atomic": 0.036886449208715144,
"volume": 81.33068008322122,
"volume_molar": 16.326160118922893,
"formula_full": "Sr1 Sn1 O1",
"formula_reduced": "SrSnO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6729667111111111,
"spacegroup": 187
},
{
"id": "jvasp-113489",
"created_at": "2022-09-04T14:38:46.136245Z",
"updated_at": "2022-09-04T14:38:46.136272Z",
"structure_string": "Rb1 Cl1\n1.0\n5.356529 0.000000 -0.000000\n-2.678265 4.638890 0.000000\n0.000000 -0.000000 4.831372\nRb Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.333335 0.666667 0.000000 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"Cl"
],
"chemical_system": "Cl-Rb",
"density": 1.6725615021541271,
"density_atomic": 0.016659500762829894,
"volume": 120.05161670044347,
"volume_molar": 36.14838671178187,
"formula_full": "Rb1 Cl1",
"formula_reduced": "RbCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.1801249999999999,
"spacegroup": 187
},
{
"id": "jvasp-113051",
"created_at": "2022-09-04T14:38:46.134944Z",
"updated_at": "2022-09-04T14:38:46.134965Z",
"structure_string": "V1 P1 Pb3 O8\n1.0\n5.193971 -0.013770 5.438312\n2.170728 4.718630 5.438312\n-0.021555 -0.013770 7.520114\nV P Pb O\n1 1 3 8\ndirect\n0.405537 0.405537 0.405537 V\n0.596614 0.596615 0.596614 P\n0.789074 0.789074 0.789074 Pb\n0.204131 0.204131 0.204131 Pb\n0.995184 0.995185 0.995184 Pb\n0.672907 0.672908 0.672908 O\n0.321634 0.321634 0.321634 O\n0.722340 0.267598 0.722341 O\n0.722341 0.722341 0.267598 O\n0.267598 0.722341 0.722340 O\n0.266603 0.769432 0.266603 O\n0.266602 0.266603 0.769432 O\n0.769431 0.266603 0.266603 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"V",
"P",
"Pb",
"O"
],
"chemical_system": "O-P-Pb-V",
"density": 7.450974085683683,
"density_atomic": 0.07015192454209625,
"volume": 185.31209350071438,
"volume_molar": 8.584427012242948,
"formula_full": "V1 P1 Pb3 O8",
"formula_reduced": "VPPb3O8",
"formula_anonymous": "ABC3D8",
"energy_above_hull": 2.430071550769231,
"spacegroup": 160
},
{
"id": "jvasp-117040",
"created_at": "2022-09-04T14:38:46.130000Z",
"updated_at": "2022-09-04T14:38:46.130014Z",
"structure_string": "Al1 Cr3 O8\n1.0\n4.960255 0.018841 2.839167\n1.655090 4.676020 2.839167\n0.026549 0.018841 5.715269\nAl Cr O\n1 3 8\ndirect\n0.500001 0.500000 0.500000 Al\n0.000000 0.500000 0.500000 Cr\n0.500001 0.500000 0.000000 Cr\n0.500001 -0.000000 0.500000 Cr\n0.263227 0.263226 0.263227 O\n0.703638 0.264345 0.264346 O\n0.264346 0.264345 0.703637 O\n0.264346 0.703637 0.264346 O\n0.736775 0.736773 0.736774 O\n0.296364 0.735654 0.735655 O\n0.735655 0.735654 0.296363 O\n0.735655 0.296363 0.735655 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"Cr",
"O"
],
"chemical_system": "Al-Cr-O",
"density": 3.9161833060671025,
"density_atomic": 0.09100884353594976,
"volume": 131.85531794236934,
"volume_molar": 6.617094038362514,
"formula_full": "Al1 Cr3 O8",
"formula_reduced": "AlCr3O8",
"formula_anonymous": "AB3C8",
"energy_above_hull": 3.42286525,
"spacegroup": 166
},
{
"id": "jvasp-118664",
"created_at": "2022-09-04T14:38:46.127498Z",
"updated_at": "2022-09-04T14:38:46.127517Z",
"structure_string": "Na1 Al1 Te2\n1.0\n3.964044 -0.000000 -0.000000\n-0.000000 3.964044 -0.000000\n-0.000000 0.000000 7.724600\nNa Al Te\n1 1 2\ndirect\n0.499999 0.499999 0.439176 Na\n0.000000 -0.000000 0.934947 Al\n0.000000 -0.000000 0.597913 Te\n0.499999 0.499999 0.037964 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Al",
"Te"
],
"chemical_system": "Al-Na-Te",
"density": 4.174840268639277,
"density_atomic": 0.03295391815384751,
"volume": 121.38162088422202,
"volume_molar": 18.274430166043516,
"formula_full": "Na1 Al1 Te2",
"formula_reduced": "NaAlTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5707118333333334,
"spacegroup": 99
}
]
}