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=nsites&page=3612",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=3610",
"results": [
{
"id": "jvasp-9099",
"created_at": "2022-09-04T14:37:27.463411Z",
"updated_at": "2022-09-04T14:37:27.463433Z",
"structure_string": "Sb4 O10\n1.0\n4.546345 -0.000000 -1.719306\n-0.464529 5.342729 -1.228350\n-0.002452 0.013881 6.864097\nSb O\n4 10\ndirect\n0.621778 0.220625 0.724725 Sb\n0.897052 0.279375 0.275274 Sb\n0.378221 0.779375 0.275275 Sb\n0.102947 0.720625 0.724725 Sb\n0.575570 0.250000 -0.000001 O\n0.424429 0.750000 -0.000000 O\n0.189571 0.445889 0.202038 O\n0.987532 0.054111 0.797961 O\n0.782814 0.623871 0.405269 O\n0.377546 0.876129 0.594730 O\n0.217185 0.376129 0.594730 O\n0.622454 0.123871 0.405270 O\n0.012467 0.945889 0.202038 O\n0.810428 0.554111 0.797961 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Sb",
"O"
],
"chemical_system": "O-Sb",
"density": 6.4416208347966455,
"density_atomic": 0.08393575355288883,
"volume": 166.7942373470019,
"volume_molar": 7.174702680432104,
"formula_full": "Sb4 O10",
"formula_reduced": "Sb2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.294335671428572,
"spacegroup": 15
},
{
"id": "jvasp-12978",
"created_at": "2022-09-04T14:37:07.634089Z",
"updated_at": "2022-09-04T14:37:07.634114Z",
"structure_string": "Li10 Br1 N3\n1.0\n3.669303 -6.355420 0.000000\n3.669303 6.355420 -0.000000\n-0.000000 0.000000 3.832182\nLi Br N\n10 1 3\ndirect\n0.221369 0.442738 0.000000 Li\n0.221368 0.778631 0.000000 Li\n0.557262 0.778631 0.000000 Li\n0.832380 0.664761 0.000000 Li\n0.984017 0.492009 0.500000 Li\n0.507990 0.492009 0.500000 Li\n0.507990 0.015982 0.500000 Li\n0.666667 0.333333 0.000000 Li\n0.335238 0.167619 0.000000 Li\n0.832380 0.167619 0.000000 Li\n0.000000 0.000000 0.500000 Br\n0.982955 0.491478 0.000000 N\n0.508522 0.017044 0.000000 N\n0.508521 0.491478 0.000000 N\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Br",
"N"
],
"chemical_system": "Br-Li-N",
"density": 1.7776142404654582,
"density_atomic": 0.07832927035728642,
"volume": 178.73267472224933,
"volume_molar": 7.6882380399191375,
"formula_full": "Li10 Br1 N3",
"formula_reduced": "Li10BrN3",
"formula_anonymous": "AB3C10",
"energy_above_hull": 1.921107418214285,
"spacegroup": 187
},
{
"id": "jvasp-57435",
"created_at": "2022-09-04T14:37:28.363869Z",
"updated_at": "2022-09-04T14:37:28.363888Z",
"structure_string": "Ca2 Al4 O8\n1.0\n0.000000 5.608828 0.013589\n3.783215 0.000000 0.000000\n0.000000 -1.388366 -6.965495\nCa Al O\n2 4 8\ndirect\n0.731344 0.749999 0.428753 Ca\n0.268655 0.250000 0.571247 Ca\n0.846106 0.749999 0.870121 Al\n0.153893 0.250000 0.129878 Al\n0.344017 0.749999 0.887043 Al\n0.655982 0.250000 0.112956 Al\n0.943170 0.250000 0.307623 O\n0.857882 0.250000 0.928298 O\n0.458069 0.250000 0.304088 O\n0.643289 0.749999 0.074610 O\n0.541930 0.749999 0.695911 O\n0.142117 0.749999 0.071702 O\n0.356711 0.250000 0.925389 O\n0.056830 0.749999 0.692376 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Al",
"O"
],
"chemical_system": "Al-Ca-O",
"density": 3.5527702664155814,
"density_atomic": 0.09476602888057935,
"volume": 147.73226403358404,
"volume_molar": 6.354746348598061,
"formula_full": "Ca2 Al4 O8",
"formula_reduced": "CaAl2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5745414314285715,
"spacegroup": 11
},
{
"id": "jvasp-10025",
"created_at": "2022-09-04T14:37:28.349904Z",
"updated_at": "2022-09-04T14:37:28.349936Z",
"structure_string": "Mg2 Ag4 O8\n1.0\n5.967322 -0.404847 0.578730\n2.633054 5.370275 0.578730\n3.339322 1.927959 5.453091\nMg Ag O\n2 4 8\ndirect\n0.124999 0.625001 0.625000 Mg\n0.625000 0.125000 0.625000 Mg\n0.013500 0.013500 -0.013500 Ag\n0.236500 0.236500 0.263500 Ag\n0.624999 0.625000 0.125000 Ag\n0.624999 0.625000 0.625000 Ag\n0.349824 0.349825 0.454181 O\n0.451520 0.849157 0.349661 O\n0.349824 0.349825 0.846171 O\n0.849155 0.451521 0.349661 O\n0.400843 0.798479 0.900339 O\n0.798478 0.400844 0.900339 O\n0.900174 0.900176 0.403829 O\n0.900174 0.900176 0.795819 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Ag",
"O"
],
"chemical_system": "Ag-Mg-O",
"density": 6.094412492200618,
"density_atomic": 0.08449898507478458,
"volume": 165.68246337644774,
"volume_molar": 7.1268793994036646,
"formula_full": "Mg2 Ag4 O8",
"formula_reduced": "Mg(AgO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2229767957142856,
"spacegroup": 74
},
{
"id": "jvasp-9645",
"created_at": "2022-09-04T14:37:27.472622Z",
"updated_at": "2022-09-04T14:37:27.472645Z",
"structure_string": "Al2 Sn4 O8\n1.0\n5.751144 0.334241 3.701485\n2.187401 5.329411 3.701485\n0.468493 0.334241 6.823280\nAl Sn O\n2 4 8\ndirect\n0.637116 0.637117 0.637119 Al\n0.362882 0.362883 0.362884 Al\n-0.000000 0.500000 0.000000 Sn\n0.000000 0.000000 0.000000 Sn\n0.500000 -0.000000 0.000001 Sn\n-0.000000 -0.000000 0.500000 Sn\n0.274014 0.763509 0.763511 O\n0.236490 0.236490 0.725986 O\n0.236490 0.725985 0.236491 O\n0.262588 0.262589 0.262589 O\n0.763509 0.763509 0.274016 O\n0.725985 0.236490 0.236491 O\n0.763509 0.274014 0.763511 O\n0.737410 0.737411 0.737413 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Sn",
"O"
],
"chemical_system": "Al-O-Sn",
"density": 5.707908803500974,
"density_atomic": 0.07326962333957668,
"volume": 191.0750917213721,
"volume_molar": 8.219150700542954,
"formula_full": "Al2 Sn4 O8",
"formula_reduced": "Al(SnO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.7256686,
"spacegroup": 166
},
{
"id": "jvasp-12651",
"created_at": "2022-09-04T14:37:27.516854Z",
"updated_at": "2022-09-04T14:37:27.516877Z",
"structure_string": "Mn4 Ge2 O8\n1.0\n2.983285 0.000000 0.000000\n0.000000 5.286355 0.000000\n0.000000 -0.000000 9.380166\nMn Ge O\n4 2 8\ndirect\n0.499999 0.440841 0.824550 Mn\n0.499999 0.559160 0.175450 Mn\n0.499999 0.940842 0.675451 Mn\n0.499999 0.059159 0.324550 Mn\n0.000000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.000000 0.132572 0.811582 O\n0.000000 0.867429 0.188418 O\n0.000000 0.632572 0.688419 O\n0.000000 0.367429 0.311582 O\n0.499999 0.267047 0.543214 O\n0.499999 0.732954 0.456786 O\n0.499999 0.232954 0.043214 O\n0.499999 0.767047 0.956786 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"Ge",
"O"
],
"chemical_system": "Ge-Mn-O",
"density": 5.534247056059121,
"density_atomic": 0.09463819371899694,
"volume": 147.93181748131514,
"volume_molar": 6.3633301982507735,
"formula_full": "Mn4 Ge2 O8",
"formula_reduced": "Mn2GeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.861807776108374,
"spacegroup": 55
},
{
"id": "jvasp-47613",
"created_at": "2022-09-04T14:37:28.643690Z",
"updated_at": "2022-09-04T14:37:28.643732Z",
"structure_string": "Li2 V2 Co2 O8\n1.0\n5.136407 -0.003526 -0.000000\n2.020344 4.722383 0.000000\n0.000000 0.000000 6.114468\nLi V Co O\n2 2 2 8\ndirect\n0.337496 0.337495 0.750000 Li\n0.662504 0.662503 0.250000 Li\n0.352496 0.352495 0.250000 V\n0.647504 0.647503 0.750000 V\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.234467 0.234466 0.023940 O\n0.234467 0.234466 0.476060 O\n0.236578 0.728092 0.250000 O\n0.271907 0.763421 0.750000 O\n0.728093 0.236578 0.250000 O\n0.763422 0.271907 0.750000 O\n0.765534 0.765532 0.523940 O\n0.765534 0.765532 0.976060 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"Co",
"O"
],
"chemical_system": "Co-Li-O-V",
"density": 4.0476468364319045,
"density_atomic": 0.09436722727125621,
"volume": 148.35658951552486,
"volume_molar": 6.381601890971649,
"formula_full": "Li2 V2 Co2 O8",
"formula_reduced": "LiVCoO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.6396884428571425,
"spacegroup": 63
},
{
"id": "jvasp-9739",
"created_at": "2022-09-04T14:37:07.586261Z",
"updated_at": "2022-09-04T14:37:07.586286Z",
"structure_string": "Zn2 Ga4 O8\n1.0\n5.161953 0.000000 2.980256\n1.720651 4.866737 2.980256\n-0.000000 -0.000000 5.960510\nZn Ga O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.874999 0.875001 0.875001 Zn\n0.500000 0.500000 0.000001 Ga\n0.500000 0.500000 0.500001 Ga\n-0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500001 Ga\n0.738478 0.738479 0.738479 O\n0.261522 0.261522 0.715436 O\n0.261521 0.715436 0.261522 O\n0.715435 0.261522 0.261523 O\n0.738478 0.284565 0.738479 O\n0.284564 0.738479 0.738479 O\n0.261522 0.261522 0.261522 O\n0.738478 0.738479 0.284566 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Ga",
"O"
],
"chemical_system": "Ga-O-Zn",
"density": 5.962906363008809,
"density_atomic": 0.0934959268699792,
"volume": 149.7391433903768,
"volume_molar": 6.441072848419091,
"formula_full": "Zn2 Ga4 O8",
"formula_reduced": "Zn(GaO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.8933812928571427,
"spacegroup": 227
},
{
"id": "jvasp-9367",
"created_at": "2022-09-04T14:37:27.531809Z",
"updated_at": "2022-09-04T14:37:27.531832Z",
"structure_string": "Ba1 Zn1 Cr4 O8\n1.0\n2.683241 -4.647510 0.000000\n2.683241 4.647510 0.000000\n-0.000000 -0.000000 7.166785\nBa Zn Cr O\n1 1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Zn\n0.333333 0.666667 0.739868 Cr\n0.666667 0.333333 0.739868 Cr\n0.333333 0.666667 0.260131 Cr\n0.666667 0.333333 0.260131 Cr\n0.317733 0.317733 0.678248 O\n0.682267 -0.000000 0.678248 O\n-0.000000 0.682267 0.678248 O\n0.682267 0.682267 0.321751 O\n-0.000000 0.317733 0.321751 O\n0.317733 -0.000000 0.321751 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Zn",
"Cr",
"O"
],
"chemical_system": "Ba-Cr-O-Zn",
"density": 5.004656371583948,
"density_atomic": 0.07832378195421591,
"volume": 178.74519910419656,
"volume_molar": 7.688776779854982,
"formula_full": "Ba1 Zn1 Cr4 O8",
"formula_reduced": "BaZnCr4O8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 3.094631712142857,
"spacegroup": 162
},
{
"id": "jvasp-36554",
"created_at": "2022-09-04T14:37:27.543123Z",
"updated_at": "2022-09-04T14:37:27.543149Z",
"structure_string": "Cr6 N8\n1.0\n-4.025176 -4.025176 -0.000000\n-4.025176 0.000000 -4.025176\n0.000000 -4.025176 -4.025176\nCr N\n6 8\ndirect\n0.625001 0.125000 0.125000 Cr\n0.375000 0.875001 0.875001 Cr\n0.000000 0.000000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.500000 Cr\n0.752919 0.741244 0.252919 N\n0.752919 0.252919 0.741244 N\n0.752919 0.252919 0.252919 N\n0.241244 0.252919 0.252919 N\n0.247081 0.258757 0.747082 N\n0.247081 0.747082 0.258757 N\n0.247081 0.747082 0.747082 N\n0.758757 0.747082 0.747082 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Cr",
"N"
],
"chemical_system": "Cr-N",
"density": 5.398352839141782,
"density_atomic": 0.10733550806751246,
"volume": 130.4321398580813,
"volume_molar": 5.610576470381229,
"formula_full": "Cr6 N8",
"formula_reduced": "Cr3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 5.644940742857143,
"spacegroup": 227
},
{
"id": "jvasp-10646",
"created_at": "2022-09-04T14:37:28.594948Z",
"updated_at": "2022-09-04T14:37:28.594975Z",
"structure_string": "Mg2 Mo4 O8\n1.0\n6.357110 -0.287164 -0.203055\n2.929865 5.074674 -0.000000\n2.929865 1.691558 4.784447\nMg Mo O\n2 4 8\ndirect\n0.986584 0.004473 0.004471 Mg\n0.149550 0.616816 0.616817 Mg\n0.198765 0.267078 0.267078 Mo\n0.621969 0.081053 0.648488 Mo\n0.621970 0.648489 0.081051 Mo\n0.621969 0.648489 0.648488 Mo\n0.401969 0.371346 0.371345 O\n0.401969 0.371346 0.855338 O\n0.401969 0.855338 0.371345 O\n0.818279 0.393907 0.393906 O\n0.351264 0.882911 0.882912 O\n0.891244 0.401090 0.853833 O\n0.891245 0.853833 0.401089 O\n0.891244 0.853834 0.853833 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"O"
],
"chemical_system": "Mg-Mo-O",
"density": 5.801694574218279,
"density_atomic": 0.08728962815385875,
"volume": 160.38560704283526,
"volume_molar": 6.8990335820714375,
"formula_full": "Mg2 Mo4 O8",
"formula_reduced": "Mg(MoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.0944006928571426,
"spacegroup": 160
},
{
"id": "jvasp-57784",
"created_at": "2022-09-04T14:37:27.551118Z",
"updated_at": "2022-09-04T14:37:27.551139Z",
"structure_string": "V4 Cu2 S8\n1.0\n6.054126 0.000000 3.495351\n2.018042 5.707884 3.495351\n-0.000000 -0.000000 6.990702\nV Cu S\n4 2 8\ndirect\n0.500000 0.500000 -0.000000 V\n-0.000000 0.500000 0.500000 V\n0.500000 0.500000 0.500000 V\n0.500000 -0.000000 0.500000 V\n0.125000 0.125000 0.125000 Cu\n0.875000 0.874999 0.875000 Cu\n0.256247 0.731261 0.256246 S\n0.743754 0.743753 0.743753 S\n0.256247 0.256246 0.256246 S\n0.743754 0.743753 0.268738 S\n0.268738 0.743753 0.743753 S\n0.256247 0.256246 0.731261 S\n0.731262 0.256246 0.256246 S\n0.743754 0.268738 0.743753 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Cu",
"S"
],
"chemical_system": "Cu-S-V",
"density": 4.037563729972806,
"density_atomic": 0.05795363116234751,
"volume": 241.57243850314256,
"volume_molar": 10.391308774302631,
"formula_full": "V4 Cu2 S8",
"formula_reduced": "V2CuS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.464072692857143,
"spacegroup": 227
}
]
}