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=-volume&page=604",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=602",
"results": [
{
"id": "jvasp-30532",
"created_at": "2022-09-04T14:37:16.688503Z",
"updated_at": "2022-09-04T14:37:16.688525Z",
"structure_string": "Mn8 Zn2 O18\n1.0\n4.441758 0.000080 0.000122\n0.000253 8.377793 0.000055\n0.000467 0.000058 8.377993\nMn Zn O\n8 2 18\ndirect\n0.580019 0.533561 0.340326 Mn\n0.419981 0.840331 0.466441 Mn\n0.580035 0.340331 0.966435 Mn\n0.419961 0.033559 0.840331 Mn\n0.580039 0.966442 0.159669 Mn\n0.580016 0.159668 0.533559 Mn\n0.419982 0.466438 0.659671 Mn\n0.419970 0.659670 0.033562 Mn\n0.969842 0.749993 0.750008 Zn\n0.030159 0.250006 0.249993 Zn\n0.551638 0.857339 0.956282 O\n0.551634 0.543724 0.857334 O\n0.448369 0.456277 0.142662 O\n0.448353 0.357341 0.456284 O\n0.448365 0.142662 0.043718 O\n0.448368 0.043722 0.357341 O\n0.946886 0.181433 0.484123 O\n0.946900 0.015881 0.181428 O\n0.053104 0.515870 0.681438 O\n0.946899 0.318569 0.015863 O\n0.053111 0.818566 0.515879 O\n0.053101 0.984120 0.818573 O\n0.551646 0.642657 0.543713 O\n0.053103 0.681432 0.984134 O\n0.500000 0.250000 0.750000 O\n0.499999 0.750001 0.249998 O\n0.946897 0.484128 0.318559 O\n0.551630 0.956277 0.642659 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 4.571613939219927,
"density_atomic": 0.08981182477053999,
"volume": 311.7629562870717,
"volume_molar": 6.705287166123117,
"formula_full": "Mn8 Zn2 O18",
"formula_reduced": "Mn4ZnO9",
"formula_anonymous": "AB4C9",
"energy_above_hull": 3.167562918965517,
"spacegroup": 85
},
{
"id": "jvasp-7070",
"created_at": "2022-09-04T14:38:15.652405Z",
"updated_at": "2022-09-04T14:38:15.652437Z",
"structure_string": "V4 Bi4 O16\n1.0\n7.302100 0.000000 -0.071795\n0.000000 11.692698 0.000000\n-3.614987 0.000000 3.686856\nV Bi O\n4 4 16\ndirect\n0.000000 0.125002 0.250000 V\n0.000000 0.874999 0.750001 V\n0.500000 0.625002 0.250000 V\n0.500000 0.374999 0.750000 V\n0.000000 0.625009 0.250000 Bi\n0.000000 0.374991 0.750001 Bi\n0.500000 0.125009 0.250000 Bi\n0.500000 0.874991 0.750000 Bi\n0.750193 0.045782 0.859949 O\n0.249806 0.954218 0.140051 O\n0.749806 0.545782 0.640051 O\n0.250193 0.454218 0.359949 O\n0.250193 0.545782 0.859949 O\n0.749806 0.454218 0.140050 O\n0.359736 0.295780 0.859561 O\n0.859736 0.795780 0.859560 O\n0.640263 0.295780 0.640439 O\n0.359736 0.704220 0.359560 O\n0.750193 0.954218 0.359948 O\n0.140264 0.204220 0.140440 O\n0.140264 0.795780 0.640440 O\n0.859736 0.204220 0.359559 O\n0.640263 0.704220 0.140439 O\n0.249806 0.045782 0.640051 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"Bi",
"O"
],
"chemical_system": "Bi-O-V",
"density": 6.9013587042797715,
"density_atomic": 0.07698385598913295,
"volume": 311.7536747365298,
"volume_molar": 7.822602132127659,
"formula_full": "V4 Bi4 O16",
"formula_reduced": "VBiO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.39882375,
"spacegroup": 88
},
{
"id": "jvasp-50228",
"created_at": "2022-09-04T14:37:02.250295Z",
"updated_at": "2022-09-04T14:37:02.250319Z",
"structure_string": "Rb6 In2 O6\n1.0\n3.846407 5.923820 0.093028\n-3.846407 5.923820 -0.093028\n-1.484320 0.000000 6.804663\nRb In O\n6 2 6\ndirect\n0.367695 0.632305 0.647548 Rb\n0.808533 0.808533 0.500000 Rb\n0.191467 0.191467 0.500000 Rb\n0.259241 0.259241 0.000000 Rb\n0.740759 0.740759 -0.000000 Rb\n0.632305 0.367695 0.352451 Rb\n0.180448 0.819552 0.146365 In\n0.819551 0.180448 0.853634 In\n0.095391 0.904609 0.833702 O\n0.161070 0.552301 0.271161 O\n0.447699 0.838930 0.271161 O\n0.838930 0.447699 0.728839 O\n0.552301 0.161070 0.728839 O\n0.904609 0.095391 0.166298 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"In",
"O"
],
"chemical_system": "In-O-Rb",
"density": 4.466237195469451,
"density_atomic": 0.04491063000768958,
"volume": 311.7302072494402,
"volume_molar": 13.409165622857866,
"formula_full": "Rb6 In2 O6",
"formula_reduced": "Rb3InO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.4218672100000001,
"spacegroup": 12
},
{
"id": "jvasp-4621",
"created_at": "2022-09-04T14:37:45.556678Z",
"updated_at": "2022-09-04T14:37:45.556704Z",
"structure_string": "Hg4 Se4 O12\n1.0\n6.083679 -0.000000 0.000000\n0.000000 6.158129 0.000000\n0.000000 0.000000 8.320360\nHg Se O\n4 4 12\ndirect\n0.500000 0.000000 0.000000 Hg\n0.000000 0.500000 0.000000 Hg\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n-0.000211 0.943654 0.250000 Se\n0.499789 0.556347 0.750000 Se\n0.500211 0.443654 0.250000 Se\n0.000211 0.056347 0.750000 Se\n0.238518 0.354957 0.250000 O\n0.738518 0.145043 0.750000 O\n0.120204 0.198807 0.586731 O\n0.620204 0.301193 0.413269 O\n0.379796 0.698808 0.913269 O\n0.620204 0.301193 0.086731 O\n0.879796 0.801193 0.413269 O\n0.379796 0.698808 0.586731 O\n0.761482 0.645044 0.750000 O\n0.120204 0.198807 0.913269 O\n0.879796 0.801193 0.086731 O\n0.261482 0.854957 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Hg",
"Se",
"O"
],
"chemical_system": "Hg-O-Se",
"density": 6.979545060503618,
"density_atomic": 0.06416124834397013,
"volume": 311.7146333060647,
"volume_molar": 9.385946993604527,
"formula_full": "Hg4 Se4 O12",
"formula_reduced": "HgSeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.3515876933333333,
"spacegroup": 62
},
{
"id": "jvasp-23777",
"created_at": "2022-09-04T14:37:50.616570Z",
"updated_at": "2022-09-04T14:37:50.616595Z",
"structure_string": "Hf10 Ga6\n1.0\n3.986136 -6.904190 0.000000\n3.986136 6.904190 -0.000000\n-0.000000 -0.000000 5.662972\nHf Ga\n10 6\ndirect\n0.333334 0.666668 0.000000 Hf\n0.666668 0.333334 0.500000 Hf\n0.666668 0.333334 0.000000 Hf\n0.333334 0.666668 0.500000 Hf\n0.240790 0.000000 0.250000 Hf\n0.240790 0.240790 0.750000 Hf\n0.000000 0.759211 0.750000 Hf\n0.000000 0.240790 0.250000 Hf\n0.759211 0.759211 0.250000 Hf\n0.759211 0.000000 0.750000 Hf\n0.607545 0.000000 0.250000 Ga\n0.607545 0.607545 0.750000 Ga\n0.000000 0.392455 0.750000 Ga\n0.000000 0.607545 0.250000 Ga\n0.392456 0.392456 0.250000 Ga\n0.392455 0.000000 0.750000 Ga\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Hf",
"Ga"
],
"chemical_system": "Ga-Hf",
"density": 11.737382413002132,
"density_atomic": 0.051331118340895876,
"volume": 311.7017613709905,
"volume_molar": 11.73194926322522,
"formula_full": "Hf10 Ga6",
"formula_reduced": "Hf5Ga3",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.746548996875001,
"spacegroup": 193
},
{
"id": "jvasp-88857",
"created_at": "2022-09-04T14:35:48.506466Z",
"updated_at": "2022-09-04T14:35:48.506479Z",
"structure_string": "Mg8 Ge4 O16\n1.0\n4.963323 -0.000000 0.000000\n0.000000 6.064353 0.000000\n0.000000 0.000000 10.355273\nMg Ge O\n8 4 16\ndirect\n0.007307 0.750000 0.724239 Mg\n0.507307 0.250000 0.775760 Mg\n0.992692 0.250000 0.275760 Mg\n0.492692 0.750000 0.224240 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.937145 0.750000 0.404911 Ge\n0.062854 0.250000 0.595089 Ge\n0.562854 0.750000 0.904911 Ge\n0.437146 0.250000 0.095089 Ge\n0.291285 0.750000 0.408112 O\n0.791285 0.250000 0.091888 O\n0.235441 0.480447 0.664970 O\n0.769817 0.750000 0.560755 O\n0.269817 0.250000 0.939245 O\n0.230183 0.250000 0.439245 O\n0.730182 0.750000 0.060755 O\n0.735441 0.980447 0.835030 O\n0.235441 0.019553 0.664970 O\n0.264559 0.480447 0.164970 O\n0.764558 0.519553 0.335030 O\n0.264559 0.019553 0.164970 O\n0.764558 0.980447 0.335030 O\n0.735441 0.519553 0.835030 O\n0.208714 0.750000 0.908112 O\n0.708714 0.250000 0.591888 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Mg",
"Ge",
"O"
],
"chemical_system": "Ge-Mg-O",
"density": 3.947690658800275,
"density_atomic": 0.08983373702392697,
"volume": 311.6869110381357,
"volume_molar": 6.703651611861611,
"formula_full": "Mg8 Ge4 O16",
"formula_reduced": "Mg2GeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.0613154357142855,
"spacegroup": 62
},
{
"id": "jvasp-44407",
"created_at": "2022-09-04T14:38:33.846385Z",
"updated_at": "2022-09-04T14:38:33.846411Z",
"structure_string": "Na4 V2 C2 S2 O14\n1.0\n0.000000 5.225553 -0.028824\n6.656603 0.000000 0.000000\n0.000000 -0.101379 -8.959807\nNa V C S O\n4 2 2 2 14\ndirect\n0.771560 0.000571 0.216938 Na\n0.771560 0.499429 0.216938 Na\n0.228439 0.500571 0.783061 Na\n0.228439 0.999429 0.783061 Na\n0.220428 0.250000 0.355998 V\n0.779571 0.750000 0.644002 V\n0.290349 0.250000 0.078967 C\n0.709650 0.750000 0.921032 C\n0.283601 0.750000 0.415690 S\n0.716399 0.250000 0.584310 S\n0.521895 0.750000 0.822260 O\n0.804827 0.070460 0.667161 O\n0.804827 0.429540 0.667161 O\n0.173439 0.750000 0.568898 O\n0.430104 0.250000 0.571465 O\n0.569896 0.750000 0.428535 O\n0.062399 0.250000 0.140238 O\n0.195172 0.570459 0.332839 O\n0.195172 0.929540 0.332839 O\n0.478104 0.250000 0.177740 O\n0.937600 0.750000 0.859762 O\n0.673335 0.750000 0.059832 O\n0.826560 0.250000 0.431102 O\n0.326664 0.250000 0.940168 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Na",
"V",
"C",
"S",
"O"
],
"chemical_system": "C-Na-O-S-V",
"density": 2.6957283956716678,
"density_atomic": 0.0770017453359344,
"volume": 311.6812469028533,
"volume_molar": 7.820784754588736,
"formula_full": "Na4 V2 C2 S2 O14",
"formula_reduced": "Na2VCSO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.6761213916666664,
"spacegroup": 11
},
{
"id": "jvasp-97658",
"created_at": "2022-09-04T14:35:46.563608Z",
"updated_at": "2022-09-04T14:35:46.563634Z",
"structure_string": "Pb8 O12\n1.0\n5.763583 -0.798734 0.000462\n-0.969994 6.708040 -0.000085\n-0.000498 -0.000195 8.226025\nPb O\n8 12\ndirect\n-0.000001 0.000011 0.250000 Pb\n0.537649 0.140789 0.500007 Pb\n0.000007 0.500003 0.749992 Pb\n0.462356 0.859194 0.000011 Pb\n0.462345 0.359198 -0.000020 Pb\n-0.000017 -0.000007 0.750009 Pb\n-0.000002 0.500005 0.250002 Pb\n0.537641 0.640806 0.499987 Pb\n0.256463 0.811950 0.288940 O\n0.256461 0.311949 0.288954 O\n0.743540 0.688048 0.788952 O\n0.256457 0.311925 0.711055 O\n0.743547 0.688065 0.211059 O\n0.256454 0.811941 0.711050 O\n-0.155145 0.961677 0.500003 O\n0.743534 0.188055 0.788945 O\n0.155157 0.538332 -0.000003 O\n0.844859 0.461671 0.499999 O\n0.743542 0.188055 0.211053 O\n0.155150 0.038331 0.000001 O\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Pb",
"O"
],
"chemical_system": "O-Pb",
"density": 9.854585267621616,
"density_atomic": 0.06417163781514315,
"volume": 311.66416630370657,
"volume_molar": 9.384427396644849,
"formula_full": "Pb8 O12",
"formula_reduced": "Pb2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.4234724279999995,
"spacegroup": 63
},
{
"id": "jvasp-13041",
"created_at": "2022-09-04T14:37:51.628467Z",
"updated_at": "2022-09-04T14:37:51.628493Z",
"structure_string": "Bi4 Te4 Pt4\n1.0\n6.779918 -0.000000 -0.000000\n-0.000000 6.779918 -0.000000\n-0.000000 -0.000000 6.779918\nBi Te Pt\n4 4 4\ndirect\n0.368983 0.368983 0.368983 Bi\n0.131018 0.631018 0.868983 Bi\n0.868983 0.131018 0.631018 Bi\n0.631018 0.868983 0.131018 Bi\n0.627059 0.627059 0.627059 Te\n0.872941 0.372941 0.127059 Te\n0.127059 0.872941 0.372941 Te\n0.372941 0.127059 0.872941 Te\n0.004153 0.004153 0.004153 Pt\n0.495847 0.995847 0.504153 Pt\n0.504153 0.495847 0.995847 Pt\n0.995847 0.504153 0.495847 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Bi",
"Te",
"Pt"
],
"chemical_system": "Bi-Pt-Te",
"density": 11.331133231321592,
"density_atomic": 0.03850418383076641,
"volume": 311.65444391036567,
"volume_molar": 15.640224414231223,
"formula_full": "Bi4 Te4 Pt4",
"formula_reduced": "BiTePt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2050844888888892,
"spacegroup": 198
},
{
"id": "jvasp-25917",
"created_at": "2022-09-04T14:37:53.991110Z",
"updated_at": "2022-09-04T14:37:53.991126Z",
"structure_string": "Rb2 Al2 As4 O14\n1.0\n6.311594 -0.010199 -0.021061\n-1.402544 6.247458 0.037355\n-2.045475 -1.427185 7.904894\nRb Al As O\n2 2 4 14\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 -0.000000 0.500000 Rb\n0.620089 0.309935 0.773182 Al\n0.379912 0.690065 0.226818 Al\n0.171993 0.469500 0.812485 As\n0.828008 0.530499 0.187516 As\n0.506707 0.754631 0.662565 As\n0.493294 0.245369 0.337436 As\n0.216301 0.631538 0.651287 O\n0.672533 0.616924 0.780079 O\n0.783700 0.368461 0.348713 O\n0.538738 0.748903 0.465599 O\n0.666630 0.711783 0.182033 O\n0.427395 0.992920 0.224544 O\n0.572606 0.007080 0.775457 O\n0.097715 0.685137 0.273125 O\n0.327467 0.383075 0.219920 O\n0.222356 0.650741 0.989796 O\n0.461263 0.251097 0.534401 O\n0.333371 0.288216 0.817967 O\n0.902286 0.314862 0.726876 O\n0.777644 0.349258 0.010204 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Rb",
"Al",
"As",
"O"
],
"chemical_system": "Al-As-O-Rb",
"density": 3.9890393600742056,
"density_atomic": 0.07060014822763105,
"volume": 311.614076631496,
"volume_molar": 8.529926510328616,
"formula_full": "Rb2 Al2 As4 O14",
"formula_reduced": "RbAlAs2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.276290072727273,
"spacegroup": 2
},
{
"id": "jvasp-42757",
"created_at": "2022-09-04T14:35:59.799098Z",
"updated_at": "2022-09-04T14:35:59.799121Z",
"structure_string": "Li5 Fe7 O3 F13\n1.0\n6.055639 0.115214 0.018189\n-2.926141 5.237106 -0.003743\n-2.979342 -1.790494 9.711324\nLi Fe O F\n5 7 3 13\ndirect\n0.474777 0.731807 0.258415 Li\n0.870398 0.179251 0.566153 Li\n0.095355 0.806726 0.436507 Li\n0.030174 0.768166 0.745514 Li\n0.123759 0.319442 0.930186 Li\n0.932414 0.697367 0.075173 Fe\n0.515439 0.020403 0.013363 Fe\n0.958704 0.247887 0.245402 Fe\n0.512934 0.240885 0.241746 Fe\n0.482627 0.491867 0.521723 Fe\n0.491277 0.281994 0.732806 Fe\n0.487649 0.711007 0.731259 Fe\n0.229603 0.368375 0.621029 O\n0.299059 0.893566 0.133325 O\n0.742522 0.379154 0.121583 O\n0.732487 0.093068 0.374156 F\n0.750427 0.871082 0.133263 F\n0.235248 0.610601 0.372216 F\n0.237850 0.367972 0.133575 F\n0.238533 0.134578 0.368526 F\n0.700459 0.592207 0.375056 F\n0.770132 0.868799 0.631448 F\n0.786811 0.647641 0.866934 F\n0.772481 0.397811 0.632824 F\n0.264968 0.126136 0.868896 F\n0.265244 0.887102 0.630387 F\n0.722699 0.111057 0.865720 F\n0.275981 0.654061 0.872816 F\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 3.84012898993408,
"density_atomic": 0.08985909297378779,
"volume": 311.59896092171437,
"volume_molar": 6.701760011929656,
"formula_full": "Li5 Fe7 O3 F13",
"formula_reduced": "Li5Fe7O3F13",
"formula_anonymous": "A3B5C7D13",
"energy_above_hull": 1.426704381160714,
"spacegroup": 1
},
{
"id": "jvasp-63322",
"created_at": "2022-09-04T14:35:46.583788Z",
"updated_at": "2022-09-04T14:35:46.583816Z",
"structure_string": "Li4 Au4 F16\n1.0\n0.000000 4.871526 0.012634\n6.390745 0.000000 0.000000\n0.000000 -0.526345 -10.009967\nLi Au F\n4 4 16\ndirect\n-0.000001 0.088739 0.750000 Li\n-0.000000 0.911262 0.250000 Li\n0.500000 0.411324 0.750000 Li\n0.500000 0.588677 0.250000 Li\n0.500000 0.000000 0.000000 Au\n0.500000 0.000000 0.500000 Au\n0.000000 0.500000 0.000000 Au\n-0.000000 0.500000 0.500000 Au\n0.298028 0.595936 0.624395 F\n0.701971 0.595936 0.875606 F\n0.797928 0.904071 0.624456 F\n0.202071 0.904071 0.875545 F\n0.202072 0.095930 0.375545 F\n0.797928 0.095930 0.124456 F\n0.317894 0.149161 0.641081 F\n0.182070 0.649095 0.358881 F\n0.682106 0.850840 0.358920 F\n0.317895 0.850840 0.141081 F\n0.298029 0.404065 0.124395 F\n0.817931 0.649095 0.141119 F\n0.817930 0.350906 0.641119 F\n0.182069 0.350906 0.858882 F\n0.682105 0.149161 0.858920 F\n0.701971 0.404065 0.375606 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Au",
"F"
],
"chemical_system": "Au-F-Li",
"density": 5.966558314561509,
"density_atomic": 0.07702315611042176,
"volume": 311.5946062453371,
"volume_molar": 7.818610745275813,
"formula_full": "Li4 Au4 F16",
"formula_reduced": "LiAuF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 15
}
]
}