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=-energy_above_hull&page=1133",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1131",
"results": [
{
"id": "jvasp-44063",
"created_at": "2022-09-04T14:36:57.712386Z",
"updated_at": "2022-09-04T14:36:57.712420Z",
"structure_string": "Li1 V6 O7 F5\n1.0\n4.825543 -0.004562 0.010815\n0.105781 5.591850 0.073460\n0.134254 0.711081 7.520206\nLi V O F\n1 6 7 5\ndirect\n0.495275 0.904464 0.091769 Li\n0.000322 -0.002336 0.997819 V\n0.028506 0.330644 0.667355 V\n0.483806 0.854285 0.660134 V\n0.494731 0.481361 0.994709 V\n0.552121 0.178268 0.357840 V\n0.951444 0.666823 0.326569 V\n0.815288 0.369771 0.437652 O\n0.789366 0.690079 0.093866 O\n0.699267 0.866243 0.432423 O\n0.312137 0.795112 0.899952 O\n0.309418 0.148478 0.562494 O\n0.184727 0.292892 0.902013 O\n0.680487 0.185875 0.108133 O\n0.696311 0.530388 0.754249 F\n0.200897 0.966672 0.237279 F\n0.196696 0.646549 0.562020 F\n0.302951 0.475268 0.241841 F\n0.802235 0.031666 0.760294 F\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 4.257121444376023,
"density_atomic": 0.09374971217147264,
"volume": 202.66728888989127,
"volume_molar": 6.423636532328996,
"formula_full": "Li1 V6 O7 F5",
"formula_reduced": "LiV6O7F5",
"formula_anonymous": "AB5C6D7",
"energy_above_hull": 2.716464795394737,
"spacegroup": 1
},
{
"id": "jvasp-119645",
"created_at": "2022-09-04T14:38:50.324901Z",
"updated_at": "2022-09-04T14:38:50.324912Z",
"structure_string": "Ta1 Nb1 Cu3 O8\n1.0\n5.224224 0.001239 0.672442\n2.020361 4.866462 1.553497\n-0.005859 0.019609 6.029318\nTa Nb Cu O\n1 1 3 8\ndirect\n0.776717 0.464717 0.349240 Ta\n0.220623 0.537687 0.653130 Nb\n0.999973 0.001052 0.001204 Cu\n0.544909 0.925802 0.760043 Cu\n0.455655 0.075603 0.238354 Cu\n0.763148 0.800485 0.098408 O\n0.240728 0.197148 0.904105 O\n0.737890 0.255363 0.165317 O\n0.261699 0.748845 0.834718 O\n0.827491 0.683082 0.596021 O\n0.168286 0.313096 0.401090 O\n0.637359 0.262307 0.633668 O\n0.365514 0.734815 0.364703 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ta",
"Nb",
"Cu",
"O"
],
"chemical_system": "Cu-Nb-O-Ta",
"density": 6.423755133574256,
"density_atomic": 0.08487974568471547,
"volume": 153.15785756814475,
"volume_molar": 7.094909052118454,
"formula_full": "Ta1 Nb1 Cu3 O8",
"formula_reduced": "TaNbCu3O8",
"formula_anonymous": "ABC3D8",
"energy_above_hull": 2.71644215,
"spacegroup": 1
},
{
"id": "jvasp-111763",
"created_at": "2022-09-04T14:38:38.606480Z",
"updated_at": "2022-09-04T14:38:38.606496Z",
"structure_string": "Y6 Cr1 Ge2 S14\n1.0\n6.010402 -0.002360 0.013949\n-0.007770 8.388344 4.789801\n-0.022314 0.046151 9.659270\nY Cr Ge S\n6 1 2 14\ndirect\n0.738008 0.217405 0.634670 Y\n0.738014 0.634667 0.147943 Y\n0.738007 0.147935 0.217415 Y\n0.227516 0.788041 0.359519 Y\n0.227479 0.359536 0.852414 Y\n0.227499 0.852424 0.788032 Y\n0.557155 -0.000001 0.000010 Cr\n0.167015 0.333333 0.333345 Ge\n0.653825 0.666656 0.666656 Ge\n0.494166 0.908758 0.523422 S\n0.006062 0.430594 0.089403 S\n0.006082 0.480011 0.430619 S\n0.006078 0.089393 0.480029 S\n0.027142 0.666675 0.666650 S\n0.541656 0.333334 0.333341 S\n0.319934 0.103084 0.139452 S\n0.791048 0.246269 0.898036 S\n0.791058 0.855726 0.246237 S\n0.494169 0.523425 0.567782 S\n0.319942 0.757463 0.103066 S\n0.319950 0.139438 0.757496 S\n0.791049 0.898030 0.855717 S\n0.494150 0.567800 0.908750 S\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Y",
"Cr",
"Ge",
"S"
],
"chemical_system": "Cr-Ge-S-Y",
"density": 4.033217817055584,
"density_atomic": 0.04735739952996541,
"volume": 485.6685592596093,
"volume_molar": 12.716367072033776,
"formula_full": "Y6 Cr1 Ge2 S14",
"formula_reduced": "Y6Cr(GeS7)2",
"formula_anonymous": "AB2C6D14",
"energy_above_hull": 2.7164326956521743,
"spacegroup": 143
},
{
"id": "jvasp-45029",
"created_at": "2022-09-04T14:38:01.931893Z",
"updated_at": "2022-09-04T14:38:01.931909Z",
"structure_string": "Li2 Fe3 Ni1 O8\n1.0\n5.768632 0.069010 0.048797\n2.944080 4.961278 0.048797\n2.944080 1.699765 4.661271\nLi Fe Ni O\n2 3 1 8\ndirect\n0.122445 0.122445 0.122445 Li\n0.497936 0.497937 0.497937 Li\n0.002053 0.501272 0.501271 Fe\n0.501270 0.002054 0.501271 Fe\n0.501270 0.501271 0.002054 Fe\n0.878250 0.878253 0.878252 Ni\n0.263444 0.263444 0.263444 O\n0.249153 0.249154 0.712867 O\n0.249153 0.712867 0.249154 O\n0.712866 0.249153 0.249154 O\n0.284057 0.747837 0.747837 O\n0.747835 0.284058 0.747837 O\n0.747835 0.747837 0.284058 O\n0.742425 0.742427 0.742427 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Ni",
"O"
],
"chemical_system": "Fe-Li-Ni-O",
"density": 4.647595064756166,
"density_atomic": 0.10644733565357667,
"volume": 131.52043603572895,
"volume_molar": 5.657389847312401,
"formula_full": "Li2 Fe3 Ni1 O8",
"formula_reduced": "Li2Fe3NiO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.7163262071428576,
"spacegroup": 160
},
{
"id": "jvasp-35674",
"created_at": "2022-09-04T14:37:31.786123Z",
"updated_at": "2022-09-04T14:37:31.786148Z",
"structure_string": "Ti1 Fe1 Co1 Ge1\n1.0\n2.904948 2.904948 0.000000\n2.904948 0.000000 -2.904948\n-0.000000 2.904948 -2.904948\nTi Fe Co Ge\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.750000 0.750000 0.750000 Fe\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Ti",
"Fe",
"Co",
"Ge"
],
"chemical_system": "Co-Fe-Ge-Ti",
"density": 7.968904354679024,
"density_atomic": 0.08158586220172216,
"volume": 49.028102321330444,
"volume_molar": 7.3813533343683675,
"formula_full": "Ti1 Fe1 Co1 Ge1",
"formula_reduced": "TiFeCoGe",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.7162976708333333,
"spacegroup": 216
},
{
"id": "jvasp-61054",
"created_at": "2022-09-04T14:36:09.726652Z",
"updated_at": "2022-09-04T14:36:09.726678Z",
"structure_string": "Mn3 As3 Rh3\n1.0\n3.258636 -5.644219 0.000000\n3.258636 5.644219 0.000000\n0.000000 0.000000 3.637212\nMn As Rh\n3 3 3\ndirect\n0.598101 1.000000 0.500000 Mn\n1.000000 0.598101 0.500000 Mn\n0.401901 0.401901 0.500000 Mn\n0.000004 0.000004 0.500000 As\n0.333335 0.666666 0.000000 As\n0.666666 0.333335 0.000000 As\n0.264560 -0.000004 0.000000 Rh\n-0.000004 0.264560 0.000000 Rh\n0.735443 0.735443 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mn",
"As",
"Rh"
],
"chemical_system": "As-Mn-Rh",
"density": 8.666624535106816,
"density_atomic": 0.06726733018706789,
"volume": 133.79451770973134,
"volume_molar": 8.952549095159055,
"formula_full": "Mn3 As3 Rh3",
"formula_reduced": "MnAsRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.716253997126437,
"spacegroup": 189
},
{
"id": "jvasp-38750",
"created_at": "2022-09-04T14:37:59.934868Z",
"updated_at": "2022-09-04T14:37:59.934889Z",
"structure_string": "H6 Pt2\n1.0\n1.799441 -3.116724 -0.000000\n1.799441 3.116724 0.000000\n-0.000000 -0.000000 5.586869\nH Pt\n6 2\ndirect\n0.164129 0.328259 0.250000 H\n0.671741 0.835870 0.250000 H\n0.164130 0.835870 0.250000 H\n0.835870 0.671741 0.750000 H\n0.328259 0.164129 0.750000 H\n0.835870 0.164130 0.750000 H\n0.333333 0.666666 0.750000 Pt\n0.666666 0.333333 0.250000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"H",
"Pt"
],
"chemical_system": "H-Pt",
"density": 10.498959765387905,
"density_atomic": 0.12766020758310734,
"volume": 62.66635587907818,
"volume_molar": 4.7173202002507795,
"formula_full": "H6 Pt2",
"formula_reduced": "H3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 2.71619035,
"spacegroup": 194
},
{
"id": "jvasp-75603",
"created_at": "2022-09-04T14:36:11.311152Z",
"updated_at": "2022-09-04T14:36:11.311163Z",
"structure_string": "Y1 Mn1 As1\n1.0\n-0.000000 3.120414 3.120414\n3.120414 -0.000000 3.120414\n3.120414 3.120414 -0.000000\nY Mn As\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.749999 0.749999 0.749999 Mn\n0.499999 0.499999 0.499999 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Mn",
"As"
],
"chemical_system": "As-Mn-Y",
"density": 5.978073799955021,
"density_atomic": 0.04936903131287454,
"volume": 60.76683945827503,
"volume_molar": 12.19821535860181,
"formula_full": "Y1 Mn1 As1",
"formula_reduced": "YMnAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.716124813793104,
"spacegroup": 216
},
{
"id": "jvasp-18462",
"created_at": "2022-09-04T14:36:49.446273Z",
"updated_at": "2022-09-04T14:36:49.446304Z",
"structure_string": "U2 I2 N2\n1.0\n3.915179 0.000000 0.000000\n-0.000000 3.915179 0.000000\n-0.000000 -0.000000 9.398107\nU I N\n2 2 2\ndirect\n0.500000 0.000000 0.878888 U\n0.000000 0.500000 0.121113 U\n0.000000 0.500000 0.669911 I\n0.500000 0.000000 0.330089 I\n0.500000 0.500000 0.000000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"I",
"N"
],
"chemical_system": "I-N-U",
"density": 8.735866833495415,
"density_atomic": 0.041649291690210186,
"volume": 144.06007296902774,
"volume_molar": 14.45916728858927,
"formula_full": "U2 I2 N2",
"formula_reduced": "UIN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.716095175,
"spacegroup": 129
},
{
"id": "jvasp-56922",
"created_at": "2022-09-04T14:35:53.011469Z",
"updated_at": "2022-09-04T14:35:53.011491Z",
"structure_string": "Mn3 As3 Rh3\n1.0\n3.257363 -5.641918 -0.000000\n3.257363 5.641918 -0.000000\n0.000000 -0.000000 3.638554\nMn As Rh\n3 3 3\ndirect\n0.401918 0.401918 0.499999 Mn\n-0.000000 0.598081 0.499999 Mn\n0.598081 -0.000000 0.499999 Mn\n0.000000 0.000000 0.499999 As\n0.666667 0.333332 0.000000 As\n0.333332 0.666667 0.000000 As\n0.264568 -0.000000 0.000000 Rh\n0.735431 0.735431 0.000000 Rh\n-0.000000 0.264568 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mn",
"As",
"Rh"
],
"chemical_system": "As-Mn-Rh",
"density": 8.670348443934051,
"density_atomic": 0.06729623387427085,
"volume": 133.7370530543306,
"volume_molar": 8.948703981341854,
"formula_full": "Mn3 As3 Rh3",
"formula_reduced": "MnAsRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.71607733045977,
"spacegroup": 189
},
{
"id": "jvasp-17460",
"created_at": "2022-09-04T14:37:45.844908Z",
"updated_at": "2022-09-04T14:37:45.844935Z",
"structure_string": "Ba2 Mn3 As2 O2\n1.0\n3.766933 0.000000 -0.791343\n-0.166242 3.763263 -0.791343\n0.391001 0.408654 11.222541\nBa Mn As O\n2 3 2 2\ndirect\n0.590885 0.590883 0.181769 Ba\n0.409116 0.409115 0.818232 Ba\n0.000000 0.000000 0.000000 Mn\n0.749999 0.249998 0.500000 Mn\n0.250000 0.750000 0.500000 Mn\n0.184227 0.184226 0.368455 As\n0.815774 0.815772 0.631547 As\n0.999998 0.500000 0.000000 O\n0.499999 -0.000000 0.000000 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Mn",
"As",
"O"
],
"chemical_system": "As-Ba-Mn-O",
"density": 6.387242364307279,
"density_atomic": 0.05571836573927391,
"volume": 161.52663274644857,
"volume_molar": 10.808179098754875,
"formula_full": "Ba2 Mn3 As2 O2",
"formula_reduced": "Ba2Mn3(AsO)2",
"formula_anonymous": "A2B2C2D3",
"energy_above_hull": 2.716050462681992,
"spacegroup": 139
},
{
"id": "jvasp-97728",
"created_at": "2022-09-04T14:36:19.829248Z",
"updated_at": "2022-09-04T14:36:19.829278Z",
"structure_string": "Ba4 V8 Te4 O32\n1.0\n5.658669 0.000000 0.000000\n0.000000 9.118135 -2.956439\n0.000000 -0.035629 13.936962\nBa V Te O\n4 8 4 32\ndirect\n0.686411 0.404501 0.157050 Ba\n0.313590 0.595500 0.842950 Ba\n0.813590 0.904501 0.657050 Ba\n0.186410 0.095499 0.342950 Ba\n0.162883 0.078212 0.087647 V\n0.852941 0.351002 0.864978 V\n0.662884 0.421788 0.412353 V\n0.837117 0.921788 0.912353 V\n0.337117 0.578212 0.587647 V\n0.147059 0.648998 0.135022 V\n0.647059 0.851002 0.364978 V\n0.352941 0.148998 0.635022 V\n0.663418 0.811242 0.096511 Te\n0.163418 0.688759 0.403489 Te\n0.836582 0.311242 0.596511 Te\n0.336582 0.188759 0.903489 Te\n0.396975 0.663479 0.059086 O\n0.383293 0.298771 0.736327 O\n0.531873 0.412114 0.543095 O\n0.968128 0.912114 0.043095 O\n0.468128 0.587886 0.456904 O\n0.869654 0.501476 0.356675 O\n0.490016 0.691397 0.682331 O\n0.031873 0.087886 0.956904 O\n0.874691 0.630187 0.063533 O\n0.883293 0.201229 0.763672 O\n0.009984 0.191397 0.182331 O\n0.896975 0.836522 0.440914 O\n0.675955 0.998090 0.325471 O\n0.175955 0.501910 0.174529 O\n0.324045 0.001910 0.674529 O\n0.625309 0.130187 0.563533 O\n0.606930 0.808994 0.958365 O\n0.603025 0.336521 0.940914 O\n0.374691 0.869813 0.436467 O\n0.509984 0.308603 0.317669 O\n0.616707 0.701229 0.263672 O\n0.824046 0.498090 0.825471 O\n0.393070 0.191006 0.041635 O\n0.630346 0.001476 0.856675 O\n0.116707 0.798772 0.236328 O\n0.125309 0.369813 0.936467 O\n0.990016 0.808603 0.817669 O\n0.103025 0.163479 0.559086 O\n0.369654 -0.001476 0.143325 O\n0.893071 0.308994 0.458365 O\n0.106930 0.691006 0.541635 O\n0.130346 0.498524 0.643325 O\n",
"nsites": 48,
"nelements": 4,
"elements": [
"Ba",
"V",
"Te",
"O"
],
"chemical_system": "Ba-O-Te-V",
"density": 4.574198972340758,
"density_atomic": 0.06680561178872704,
"volume": 718.5025137079824,
"volume_molar": 9.01442348742354,
"formula_full": "Ba4 V8 Te4 O32",
"formula_reduced": "BaV2TeO8",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.7160308447222223,
"spacegroup": 14
}
]
}