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=261",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=259",
"results": [
{
"id": "jvasp-93488",
"created_at": "2022-09-04T14:35:54.563993Z",
"updated_at": "2022-09-04T14:35:54.564021Z",
"structure_string": "Te2 Br4\n1.0\n7.979926 0.000000 0.000000\n0.000000 7.979926 0.000000\n0.000000 0.000000 3.890955\nTe Br\n2 4\ndirect\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.500001 Te\n0.319747 0.319747 0.000000 Br\n0.680252 0.680252 0.000000 Br\n0.819747 0.180252 0.500001 Br\n0.180252 0.819747 0.500001 Br\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Te",
"Br"
],
"chemical_system": "Br-Te",
"density": 3.8523346722981366,
"density_atomic": 0.02421571597786948,
"volume": 247.77297542981364,
"volume_molar": 24.868728909372653,
"formula_full": "Te2 Br4",
"formula_reduced": "TeBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1843919922222222,
"spacegroup": 136
},
{
"id": "jvasp-93486",
"created_at": "2022-09-04T14:36:35.830987Z",
"updated_at": "2022-09-04T14:36:35.831017Z",
"structure_string": "V2 O2 F2\n1.0\n3.272053 0.000000 0.000000\n-1.636027 0.944560 7.102231\n1.636027 -2.833681 0.000000\nV O F\n2 2 2\ndirect\n0.604096 0.812289 0.604097 V\n0.395903 0.187711 0.395903 V\n0.298399 0.895200 0.298400 O\n0.701600 0.104800 0.701599 O\n0.113716 0.341150 0.113716 F\n0.886284 0.658850 0.886284 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.334159002070062,
"density_atomic": 0.09111401171695896,
"volume": 65.85156209166483,
"volume_molar": 6.609456269698093,
"formula_full": "V2 O2 F2",
"formula_reduced": "VOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0991959941666665,
"spacegroup": 166
},
{
"id": "jvasp-93483",
"created_at": "2022-09-04T14:36:32.396259Z",
"updated_at": "2022-09-04T14:36:32.396287Z",
"structure_string": "Mn1 Te1 O4\n1.0\n4.446759 -1.250530 -0.761774\n5.905529 4.222992 -1.186528\n5.905526 2.546778 1.556905\nMn Te O\n1 1 4\ndirect\n0.499995 0.500002 0.500000 Mn\n0.499999 -0.000002 0.500004 Te\n0.134326 0.000086 0.182691 O\n0.499845 0.500012 0.210945 O\n0.865690 -0.000085 0.817302 O\n0.500147 0.499990 0.789058 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mn",
"Te",
"O"
],
"chemical_system": "Mn-O-Te",
"density": 5.808901130803431,
"density_atomic": 0.08513662261546918,
"volume": 70.4749591383228,
"volume_molar": 7.073502066437138,
"formula_full": "Mn1 Te1 O4",
"formula_reduced": "MnTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.5125865013409965,
"spacegroup": 65
},
{
"id": "jvasp-93482",
"created_at": "2022-09-04T14:36:32.029948Z",
"updated_at": "2022-09-04T14:36:32.029968Z",
"structure_string": "Nb1 Cr1 O4\n1.0\n5.543788 0.194273 0.000000\n2.600915 4.899651 -0.000000\n-4.072352 -2.546962 2.774936\nNb Cr O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Nb\n0.750001 0.250000 0.500001 Cr\n0.542291 0.042290 0.500001 O\n0.210273 0.210272 -0.000000 O\n0.957711 0.457709 0.500001 O\n0.789729 0.789727 -0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nb",
"Cr",
"O"
],
"chemical_system": "Cr-Nb-O",
"density": 4.689407135952337,
"density_atomic": 0.08111132326061146,
"volume": 73.97240926179866,
"volume_molar": 7.42453768218132,
"formula_full": "Nb1 Cr1 O4",
"formula_reduced": "NbCrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.2811918,
"spacegroup": 119
},
{
"id": "jvasp-93481",
"created_at": "2022-09-04T14:36:31.868409Z",
"updated_at": "2022-09-04T14:36:31.868438Z",
"structure_string": "Ta1 Cr1 O4\n1.0\n4.636798 0.009076 0.035374\n-4.642755 3.063371 -0.040759\n-0.108557 0.007927 4.635211\nTa Cr O\n1 1 4\ndirect\n0.502732 0.499998 0.002353 Ta\n0.502712 0.999981 0.502352 Cr\n0.199499 -0.000009 0.805496 O\n0.197694 0.499978 0.697424 O\n0.805946 -0.000024 0.199220 O\n0.807726 0.499975 0.307289 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ta",
"Cr",
"O"
],
"chemical_system": "Cr-O-Ta",
"density": 7.465647242123413,
"density_atomic": 0.09084449252026595,
"volume": 66.04693177917743,
"volume_molar": 6.629065332338729,
"formula_full": "Ta1 Cr1 O4",
"formula_reduced": "TaCrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.4686467666666667,
"spacegroup": 65
},
{
"id": "jvasp-93480",
"created_at": "2022-09-04T14:36:32.145398Z",
"updated_at": "2022-09-04T14:36:32.145407Z",
"structure_string": "Li2 Cr1 O3\n1.0\n-0.000000 3.871398 0.000000\n-4.658854 1.935698 0.000000\n0.000000 0.000000 2.929789\nLi Cr O\n2 1 3\ndirect\n0.654054 0.691894 0.500000 Li\n0.345947 0.308105 0.500000 Li\n0.000000 0.000000 0.000000 Cr\n0.135815 0.728371 0.500000 O\n0.864187 0.271628 0.500000 O\n0.500000 -0.000000 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O",
"density": 3.578484819540046,
"density_atomic": 0.11354499205668234,
"volume": 52.84248905495334,
"volume_molar": 5.303748453294807,
"formula_full": "Li2 Cr1 O3",
"formula_reduced": "Li2CrO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.1132096500000004,
"spacegroup": 65
},
{
"id": "jvasp-93479",
"created_at": "2022-09-04T14:36:31.203802Z",
"updated_at": "2022-09-04T14:36:31.203819Z",
"structure_string": "Cr1 Ga1 O4\n1.0\n4.466994 0.015865 0.186979\n-4.477883 2.970819 -0.180909\n0.026156 -0.008990 4.470408\nCr Ga O\n1 1 4\ndirect\n0.571271 0.066747 0.498168 Cr\n0.485284 0.480751 0.998160 Ga\n0.192272 0.978351 0.788632 O\n0.190806 0.496670 0.687970 O\n0.773451 0.978346 0.207727 O\n0.811535 0.496668 0.308416 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Ga",
"O"
],
"chemical_system": "Cr-Ga-O",
"density": 5.171863717516446,
"density_atomic": 0.10062323305071931,
"volume": 59.62837625159281,
"volume_molar": 5.984841251288885,
"formula_full": "Cr1 Ga1 O4",
"formula_reduced": "CrGaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.275135620833334,
"spacegroup": 35
},
{
"id": "jvasp-93478",
"created_at": "2022-09-04T14:36:30.892930Z",
"updated_at": "2022-09-04T14:36:30.892950Z",
"structure_string": "Cr1 Ir1 O4\n1.0\n-0.000674 3.071603 0.000004\n-4.486282 3.070484 -0.097190\n-0.082257 0.000007 4.486816\nCr Ir O\n1 1 4\ndirect\n0.499959 0.999526 0.000416 Cr\n0.499963 0.499526 0.500417 Ir\n0.189252 0.810238 0.811157 O\n0.199934 0.299538 0.700381 O\n0.810670 0.188813 0.189677 O\n0.799991 0.699513 0.300452 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Ir",
"O"
],
"chemical_system": "Cr-Ir-O",
"density": 8.275602842605196,
"density_atomic": 0.09701839399329194,
"volume": 61.843942710645706,
"volume_molar": 6.207215469281406,
"formula_full": "Cr1 Ir1 O4",
"formula_reduced": "CrIrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.270185416666666,
"spacegroup": 65
},
{
"id": "jvasp-93477",
"created_at": "2022-09-04T14:36:22.315900Z",
"updated_at": "2022-09-04T14:36:22.315924Z",
"structure_string": "Fe2 O2 F2\n1.0\n3.761854 0.000024 0.000058\n0.000036 5.719754 0.000003\n0.000044 0.000003 2.880559\nFe O F\n2 2 2\ndirect\n0.249999 0.146354 0.750001 Fe\n0.750000 0.853641 0.249999 Fe\n0.249999 0.921935 0.249999 O\n0.750000 0.078055 0.750001 O\n0.250006 0.365230 0.249987 F\n0.749993 0.634777 0.750013 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.867585160394953,
"density_atomic": 0.0968044202999087,
"volume": 61.98064077457896,
"volume_molar": 6.22093571899183,
"formula_full": "Fe2 O2 F2",
"formula_reduced": "FeOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1537330941666666,
"spacegroup": 59
},
{
"id": "jvasp-93476",
"created_at": "2022-09-04T14:36:21.778301Z",
"updated_at": "2022-09-04T14:36:21.778322Z",
"structure_string": "Li2 V1 O2 F1\n1.0\n-0.000004 -2.014115 -2.014074\n-2.066642 2.185754 -4.199899\n4.133213 0.000033 -0.000025\nLi V O F\n2 1 2 1\ndirect\n0.692543 0.614936 0.307426 Li\n0.307461 0.385062 0.692573 Li\n0.000000 0.000000 0.000000 V\n0.346369 0.307254 0.153614 O\n0.653635 0.692744 0.846386 O\n0.000001 0.000000 0.500000 F\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.617920196602193,
"density_atomic": 0.11286906790209136,
"volume": 53.158939925017535,
"volume_molar": 5.335510314680658,
"formula_full": "Li2 V1 O2 F1",
"formula_reduced": "Li2VO2F",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 1.502981913750001,
"spacegroup": 71
},
{
"id": "jvasp-93475",
"created_at": "2022-09-04T14:36:18.883498Z",
"updated_at": "2022-09-04T14:36:18.883520Z",
"structure_string": "Be1 P1 O4\n1.0\n-2.364592 2.364592 3.686369\n2.364592 -2.364592 3.686369\n2.364592 2.364592 -3.686369\nBe P O\n1 1 4\ndirect\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 P\n0.777330 0.121278 0.141439 O\n0.364109 0.222670 0.343949 O\n0.878722 0.020161 0.656050 O\n0.979839 0.635891 0.858560 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"P",
"O"
],
"chemical_system": "Be-O-P",
"density": 2.094317318826727,
"density_atomic": 0.07277463265402195,
"volume": 82.44631104528708,
"volume_molar": 8.275054837624358,
"formula_full": "Be1 P1 O4",
"formula_reduced": "BePO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.3112659333333334,
"spacegroup": 82
},
{
"id": "jvasp-93473",
"created_at": "2022-09-04T14:36:17.736609Z",
"updated_at": "2022-09-04T14:36:17.736646Z",
"structure_string": "Th1 U1 O4\n1.0\n0.000043 -2.763861 -2.763842\n0.000051 2.763642 -2.763622\n5.538814 0.000008 -0.000093\nTh U O\n1 1 4\ndirect\n0.499999 0.500000 0.500000 Th\n0.000001 0.999998 0.000001 U\n0.499996 0.000001 0.243264 O\n0.999996 0.500001 0.243269 O\n0.000002 0.499998 0.756732 O\n0.500002 -0.000001 0.756733 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"U",
"O"
],
"chemical_system": "O-Th-U",
"density": 10.48096258615323,
"density_atomic": 0.07091033806933182,
"volume": 84.61389641286951,
"volume_molar": 8.49261324083932,
"formula_full": "Th1 U1 O4",
"formula_reduced": "ThUO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.874514266666667,
"spacegroup": 123
}
]
}