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=spacegroup&page=1225",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=1223",
"results": [
{
"id": "jvasp-38155",
"created_at": "2022-09-04T14:38:31.057035Z",
"updated_at": "2022-09-04T14:38:31.057055Z",
"structure_string": "Rb4 Mg2 H8\n1.0\n0.000000 5.186242 4.051227\n0.000000 -5.186242 4.051227\n8.768813 0.000000 0.000000\nRb Mg H\n4 2 8\ndirect\n0.500000 0.999999 0.500001 Rb\n0.499999 0.000000 0.999999 Rb\n0.090358 0.409642 0.250000 Rb\n0.909642 0.590358 0.750000 Rb\n0.743738 0.756261 0.250000 Mg\n0.256261 0.243737 0.750000 Mg\n0.786000 0.047895 0.249999 H\n0.547894 0.286000 0.749999 H\n0.162631 0.337369 0.927730 H\n0.162631 0.337369 0.572269 H\n0.837368 0.662632 0.072269 H\n0.837369 0.662631 0.427731 H\n0.452107 0.714001 0.249999 H\n0.214000 0.952107 0.749999 H\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"H"
],
"chemical_system": "H-Mg-Rb",
"density": 1.7960399670517304,
"density_atomic": 0.037994249915725115,
"volume": 368.476809808151,
"volume_molar": 15.850137253288814,
"formula_full": "Rb4 Mg2 H8",
"formula_reduced": "Rb2MgH4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2010555785714283,
"spacegroup": 63
},
{
"id": "jvasp-57129",
"created_at": "2022-09-04T14:38:31.174206Z",
"updated_at": "2022-09-04T14:38:31.174231Z",
"structure_string": "Ta2 Ag2 S6\n1.0\n3.391153 0.000000 0.000000\n-1.695577 7.093320 0.000000\n0.000000 0.000000 7.803974\nTa Ag S\n2 2 6\ndirect\n0.737238 0.474478 0.509769 Ta\n0.262760 0.525522 0.009769 Ta\n0.000062 0.000125 0.759907 Ag\n-0.000062 -0.000125 0.259907 Ag\n0.673015 0.346031 0.189471 S\n0.673028 0.346057 0.830053 S\n0.326970 0.653943 0.330053 S\n0.897031 0.794066 0.009799 S\n0.102967 0.205934 0.509799 S\n0.326983 0.653968 0.689471 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ta",
"Ag",
"S"
],
"chemical_system": "Ag-S-Ta",
"density": 6.8114499574828,
"density_atomic": 0.05327055839254406,
"volume": 187.7209532198115,
"volume_molar": 11.3048200389108,
"formula_full": "Ta2 Ag2 S6",
"formula_reduced": "TaAgS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.431443292,
"spacegroup": 63
},
{
"id": "jvasp-20976",
"created_at": "2022-09-04T14:38:31.530991Z",
"updated_at": "2022-09-04T14:38:31.531014Z",
"structure_string": "Nb6 Co8 B14\n1.0\n3.174945 0.000000 -0.551551\n-0.000000 8.891767 -0.000000\n-0.011985 0.000000 9.344917\nNb Co B\n6 8 14\ndirect\n0.581272 0.944888 0.162543 Nb\n0.418731 0.444888 0.837458 Nb\n0.581272 0.555112 0.162543 Nb\n0.302145 0.750000 0.604288 Nb\n0.697858 0.250000 0.395713 Nb\n0.418731 0.055112 0.837458 Nb\n0.801066 0.994352 0.602126 Co\n0.198937 0.005648 0.397874 Co\n0.198937 0.494352 0.397874 Co\n0.801066 0.505648 0.602126 Co\n0.156112 0.750000 0.312221 Co\n0.843891 0.250000 0.687780 Co\n0.458065 0.750000 0.916125 Co\n0.541938 0.250000 0.083875 Co\n0.955676 0.250000 0.911347 B\n0.015280 0.406904 0.030559 B\n0.984723 0.593097 0.969442 B\n0.710314 0.854781 0.420624 B\n0.289689 0.145219 0.579376 B\n0.289689 0.354781 0.579376 B\n0.710314 0.645219 0.420624 B\n0.890579 0.851876 0.781152 B\n0.109424 0.148124 0.218848 B\n0.109424 0.351876 0.218848 B\n0.890579 0.648124 0.781152 B\n0.044327 0.750000 0.088653 B\n0.015280 0.093097 0.030559 B\n0.984723 0.906904 0.969442 B\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Nb",
"Co",
"B"
],
"chemical_system": "B-Co-Nb",
"density": 7.430585464115026,
"density_atomic": 0.10615857337309348,
"volume": 263.7563704025507,
"volume_molar": 5.672778531824493,
"formula_full": "Nb6 Co8 B14",
"formula_reduced": "Nb3Co4B7",
"formula_anonymous": "A3B4C7",
"energy_above_hull": 5.34252570595238,
"spacegroup": 63
},
{
"id": "jvasp-17739",
"created_at": "2022-09-04T14:38:31.722719Z",
"updated_at": "2022-09-04T14:38:31.722736Z",
"structure_string": "Sr2 In4 Pt2\n1.0\n4.505562 0.000000 0.000000\n-2.252781 5.501515 0.000000\n0.000000 -0.000000 8.017627\nSr In Pt\n2 4 2\ndirect\n0.063764 0.127527 0.750000 Sr\n0.936235 0.872472 0.250000 Sr\n0.351482 0.702966 0.947139 In\n0.351482 0.702966 0.552862 In\n0.648517 0.297033 0.052861 In\n0.648517 0.297033 0.447139 In\n0.780274 0.560549 0.750000 Pt\n0.219725 0.439450 0.250000 Pt\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sr",
"In",
"Pt"
],
"chemical_system": "In-Pt-Sr",
"density": 8.56170455901717,
"density_atomic": 0.040254354544055196,
"volume": 198.7362632096022,
"volume_molar": 14.960221889557923,
"formula_full": "Sr2 In4 Pt2",
"formula_reduced": "SrIn2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1422247137499999,
"spacegroup": 63
},
{
"id": "jvasp-26802",
"created_at": "2022-09-04T14:38:31.825430Z",
"updated_at": "2022-09-04T14:38:31.825460Z",
"structure_string": "Ag2 Bi2 S2 Cl4\n1.0\n4.037148 -0.000000 -0.000000\n-2.018573 6.900347 0.000000\n0.000000 -0.000000 8.730177\nAg Bi S Cl\n2 2 2 4\ndirect\n0.000000 0.000000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n0.287552 0.575102 0.750000 Bi\n0.712450 0.424899 0.250000 Bi\n0.919056 0.838108 0.750000 S\n0.080946 0.161892 0.250000 S\n0.658202 0.316402 0.564365 Cl\n0.341800 0.683599 0.435635 Cl\n0.341800 0.683599 0.064365 Cl\n0.658202 0.316402 0.935635 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ag",
"Bi",
"S",
"Cl"
],
"chemical_system": "Ag-Bi-Cl-S",
"density": 5.732883985652983,
"density_atomic": 0.04111794010365752,
"volume": 243.20284466561787,
"volume_molar": 14.64601763808766,
"formula_full": "Ag2 Bi2 S2 Cl4",
"formula_reduced": "AgBiSCl2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.4466859389999998,
"spacegroup": 63
},
{
"id": "jvasp-16825",
"created_at": "2022-09-04T14:38:31.921830Z",
"updated_at": "2022-09-04T14:38:31.921856Z",
"structure_string": "Pu2 Ni2\n1.0\n2.794790 0.000000 -0.982694\n0.000000 3.451842 0.000000\n0.595863 -0.000000 6.160196\nPu Ni\n2 2\ndirect\n0.199497 0.749999 0.398995 Pu\n0.800502 0.250000 0.601006 Pu\n0.436096 0.749999 0.872196 Ni\n0.563903 0.250000 0.127805 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pu",
"Ni"
],
"chemical_system": "Ni-Pu",
"density": 16.3592056955786,
"density_atomic": 0.06509388011407818,
"volume": 61.44970914300897,
"volume_molar": 9.251469953006474,
"formula_full": "Pu2 Ni2",
"formula_reduced": "PuNi",
"formula_anonymous": "AB",
"energy_above_hull": 3.1264212,
"spacegroup": 63
},
{
"id": "jvasp-9914",
"created_at": "2022-09-04T14:38:32.012823Z",
"updated_at": "2022-09-04T14:38:32.012849Z",
"structure_string": "Mg2 Sn4 O8\n1.0\n3.165039 0.000000 0.000000\n-1.582520 5.397811 0.000000\n0.000000 0.000000 10.747909\nMg Sn O\n2 4 8\ndirect\n0.387849 0.775698 0.750000 Mg\n0.612151 0.224302 0.250000 Mg\n0.869100 0.738200 0.079352 Sn\n0.130900 0.261800 0.920648 Sn\n0.869100 0.738200 0.420648 Sn\n0.130900 0.261800 0.579352 Sn\n0.222124 0.444248 0.380535 O\n0.777876 0.555752 0.619465 O\n0.777876 0.555752 0.880535 O\n0.222124 0.444248 0.119465 O\n0.985693 0.971387 0.250000 O\n0.014307 0.028613 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Sn",
"O"
],
"chemical_system": "Mg-O-Sn",
"density": 5.891233892867636,
"density_atomic": 0.0762442883473067,
"volume": 183.6203118091605,
"volume_molar": 7.898481172213249,
"formula_full": "Mg2 Sn4 O8",
"formula_reduced": "Mg(SnO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.3335709214285711,
"spacegroup": 63
},
{
"id": "jvasp-12180",
"created_at": "2022-09-04T14:38:32.399192Z",
"updated_at": "2022-09-04T14:38:32.399221Z",
"structure_string": "Ta2 Ni2 Te10\n1.0\n3.717606 0.000000 0.000000\n-1.858803 6.727965 0.000000\n0.000000 0.000000 15.283072\nTa Ni Te\n2 2 10\ndirect\n0.511206 0.022412 0.250000 Ta\n0.488796 0.977587 0.750000 Ta\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.394817 0.789631 0.574343 Te\n0.100705 0.201410 0.645110 Te\n0.605185 0.210368 0.425657 Te\n0.605185 0.210368 0.074343 Te\n0.394817 0.789631 0.925657 Te\n0.170722 0.341441 0.250000 Te\n0.899296 0.798589 0.145110 Te\n0.829280 0.658558 0.750000 Te\n0.100705 0.201410 0.854890 Te\n0.899296 0.798589 0.354890 Te\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ta",
"Ni",
"Te"
],
"chemical_system": "Ni-Ta-Te",
"density": 7.6249744407654845,
"density_atomic": 0.03662438094604253,
"volume": 382.2590208589663,
"volume_molar": 16.44298307423194,
"formula_full": "Ta2 Ni2 Te10",
"formula_reduced": "TaNiTe5",
"formula_anonymous": "ABC5",
"energy_above_hull": 1.9691357761904755,
"spacegroup": 63
},
{
"id": "jvasp-27139",
"created_at": "2022-09-04T14:38:32.430312Z",
"updated_at": "2022-09-04T14:38:32.430343Z",
"structure_string": "Mg2 V2 O6\n1.0\n4.681248 0.000000 -2.418952\n0.000000 5.254612 0.000000\n0.006138 0.000000 5.751022\nMg V O\n2 2 6\ndirect\n0.575317 0.012821 0.150634 Mg\n0.424683 0.512821 0.849366 Mg\n0.929266 0.012802 0.858529 V\n0.070735 0.512801 0.141471 V\n0.237692 0.262812 -0.000017 O\n0.762309 0.762811 0.000018 O\n0.762291 0.262812 -0.000017 O\n0.237709 0.762811 0.000017 O\n0.765587 0.012756 0.531172 O\n0.234414 0.512756 0.468829 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 2.8917488060264924,
"density_atomic": 0.07065017140076432,
"volume": 141.5424733122702,
"volume_molar": 8.523886978050347,
"formula_full": "Mg2 V2 O6",
"formula_reduced": "MgVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7412007500000002,
"spacegroup": 63
},
{
"id": "jvasp-21610",
"created_at": "2022-09-04T14:38:32.559833Z",
"updated_at": "2022-09-04T14:38:32.559856Z",
"structure_string": "Mg2 B8 Os6\n1.0\n2.931873 -0.000000 -0.000000\n-1.465937 5.961331 0.000000\n0.000000 -0.000000 9.844566\nMg B Os\n2 8 6\ndirect\n0.499999 0.000000 0.000000 Mg\n0.499999 0.000000 0.500000 Mg\n0.622804 0.245610 0.250000 B\n0.377194 0.754389 0.750000 B\n0.344313 0.688629 0.250000 B\n0.655685 0.311371 0.750000 B\n0.160070 0.320140 0.890108 B\n0.839928 0.679860 0.390108 B\n0.839928 0.679860 0.109893 B\n0.160070 0.320140 0.609893 B\n0.198019 0.396041 0.106965 Os\n0.018030 0.036060 0.750000 Os\n0.981968 0.963940 0.250000 Os\n0.801978 0.603959 0.893035 Os\n0.801978 0.603959 0.606965 Os\n0.198019 0.396041 0.393035 Os\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"B",
"Os"
],
"chemical_system": "B-Mg-Os",
"density": 12.319057042417175,
"density_atomic": 0.0929897365288464,
"volume": 172.06199949858586,
"volume_molar": 6.476134877672084,
"formula_full": "Mg2 B8 Os6",
"formula_reduced": "MgB4Os3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 5.065044297916668,
"spacegroup": 63
},
{
"id": "jvasp-36189",
"created_at": "2022-09-04T14:38:32.548315Z",
"updated_at": "2022-09-04T14:38:32.548345Z",
"structure_string": "Ba2 Pd2\n1.0\n-4.434677 0.000000 0.000000\n0.000000 0.000000 -4.709751\n-2.217338 -5.911638 -0.000000\nBa Pd\n2 2\ndirect\n0.138480 0.750000 0.723041 Ba\n0.861521 0.250000 0.276960 Ba\n0.427582 0.750000 0.144836 Pd\n0.572419 0.250000 0.855164 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Pd"
],
"chemical_system": "Ba-Pd",
"density": 6.556175940775202,
"density_atomic": 0.03239606179876503,
"volume": 123.47179804899879,
"volume_molar": 18.589113693534102,
"formula_full": "Ba2 Pd2",
"formula_reduced": "BaPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.160060835,
"spacegroup": 63
},
{
"id": "jvasp-110901",
"created_at": "2022-09-04T14:38:37.478582Z",
"updated_at": "2022-09-04T14:38:37.478609Z",
"structure_string": "La2 Si2 Os4 C2\n1.0\n5.962674 0.000235 0.000000\n-4.590996 3.804764 0.000000\n0.000000 0.000000 7.231671\nLa Si Os C\n2 2 4 2\ndirect\n0.550492 0.449506 0.250000 La\n0.449505 0.550492 0.750000 La\n0.271018 0.728979 0.250000 Si\n0.728979 0.271019 0.750000 Si\n0.834107 0.165890 0.059194 Os\n0.165889 0.834108 0.940806 Os\n0.165889 0.834108 0.559194 Os\n0.834107 0.165890 0.440806 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Si",
"Os",
"C"
],
"chemical_system": "C-La-Os-Si",
"density": 11.324559770827188,
"density_atomic": 0.060949745680094994,
"volume": 164.06959353836658,
"volume_molar": 9.880501867240302,
"formula_full": "La2 Si2 Os4 C2",
"formula_reduced": "LaSiOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.79678472,
"spacegroup": 63
}
]
}