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=-density&page=3838",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=3836",
"results": [
{
"id": "jvasp-47676",
"created_at": "2022-09-04T14:37:19.104711Z",
"updated_at": "2022-09-04T14:37:19.104736Z",
"structure_string": "Li2 Ni2 P2 O8\n1.0\n4.401245 0.030313 0.024279\n-1.000257 -5.053227 0.003025\n-1.735254 0.297251 -7.093364\nLi Ni P O\n2 2 2 8\ndirect\n0.737546 0.704171 0.984005 Li\n0.262453 0.295830 0.015994 Li\n0.974881 0.755503 0.597902 Ni\n0.025117 0.244498 0.402096 Ni\n0.355262 0.816392 0.263091 P\n0.644737 0.183609 0.736907 P\n0.165108 0.623303 0.382443 O\n0.299153 0.086846 0.611895 O\n0.643864 0.329667 0.918218 O\n0.198425 0.060494 0.211452 O\n0.801574 0.939507 0.788547 O\n0.356135 0.670334 0.081780 O\n0.700845 0.913155 0.388103 O\n0.834891 0.376698 0.617556 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Ni",
"P",
"O"
],
"chemical_system": "Li-Ni-O-P",
"density": 3.390429043436528,
"density_atomic": 0.08899026088737699,
"volume": 157.3205861000668,
"volume_molar": 6.767190813859297,
"formula_full": "Li2 Ni2 P2 O8",
"formula_reduced": "LiNiPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.065364557142857,
"spacegroup": 2
},
{
"id": "jvasp-115196",
"created_at": "2022-09-04T14:38:43.606695Z",
"updated_at": "2022-09-04T14:38:43.606731Z",
"structure_string": "Li1 I2\n1.0\n4.439860 0.000000 0.000000\n0.000000 4.409517 0.000000\n0.000000 0.000000 6.523832\nLi I\n1 2\ndirect\n0.466689 0.000000 0.000000 Li\n-0.033345 0.000000 0.745371 I\n-0.033345 0.000000 0.254628 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"I"
],
"chemical_system": "I-Li",
"density": 3.3900823560674014,
"density_atomic": 0.023488657151697342,
"volume": 127.72122223186409,
"volume_molar": 25.63850594398423,
"formula_full": "Li1 I2",
"formula_reduced": "LiI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1385454250000001,
"spacegroup": 47
},
{
"id": "jvasp-68462",
"created_at": "2022-09-04T14:36:03.262998Z",
"updated_at": "2022-09-04T14:36:03.263025Z",
"structure_string": "Sr2 Be1 P1\n1.0\n-2.188053 2.188053 5.505032\n2.188053 -2.188053 5.505032\n2.188053 2.188053 -5.505032\nSr Be P\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.749999 0.499999 Sr\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"P"
],
"chemical_system": "Be-P-Sr",
"density": 3.390066400716738,
"density_atomic": 0.03794237196221643,
"volume": 105.42303480613333,
"volume_molar": 15.871808873722856,
"formula_full": "Sr2 Be1 P1",
"formula_reduced": "Sr2BeP",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8984360549999999,
"spacegroup": 119
},
{
"id": "jvasp-96941",
"created_at": "2022-09-04T14:36:15.220258Z",
"updated_at": "2022-09-04T14:36:15.220285Z",
"structure_string": "Ca2 Al2 B6 O14\n1.0\n4.397857 0.000000 -0.000000\n0.000000 6.843360 -1.971377\n0.000000 -0.703465 7.086822\nCa Al B O\n2 2 6 14\ndirect\n0.000000 0.500000 -0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.541943 0.137117 0.862883 B\n0.458058 0.637117 0.362883 B\n0.500000 0.250000 0.250000 B\n0.541943 0.362884 0.637116 B\n0.458058 0.862883 0.137116 B\n0.500000 0.750000 0.750000 B\n0.699718 0.926372 0.780263 O\n0.328954 0.750000 0.250000 O\n0.671047 0.250001 0.750000 O\n0.699718 0.280264 0.426371 O\n0.224051 0.131738 0.868263 O\n0.300283 0.780264 0.926371 O\n0.224051 0.368263 0.631737 O\n0.300283 0.073629 0.219737 O\n0.300283 0.719737 0.573628 O\n0.300283 0.426371 0.280263 O\n0.699718 0.219737 0.073629 O\n0.775949 0.868263 0.131737 O\n0.699718 0.573629 0.719736 O\n0.775949 0.631737 0.368262 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Ca",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Ca-O",
"density": 3.3900273575309288,
"density_atomic": 0.11583743332327923,
"volume": 207.18691109997903,
"volume_molar": 5.198786426140335,
"formula_full": "Ca2 Al2 B6 O14",
"formula_reduced": "CaAlB3O7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.9632096225,
"spacegroup": 67
},
{
"id": "jvasp-114928",
"created_at": "2022-09-04T14:38:42.448166Z",
"updated_at": "2022-09-04T14:38:42.448192Z",
"structure_string": "Na1 Nb1 F4\n1.0\n-2.113024 2.113024 5.263254\n2.113024 -2.113024 5.263254\n2.113024 2.113024 -5.263254\nNa Nb F\n1 1 4\ndirect\n0.250000 0.749999 0.499999 Na\n0.500000 0.500000 0.000000 Nb\n0.303938 0.303938 0.000000 F\n0.696061 0.696061 0.000000 F\n0.489553 0.989552 0.499999 F\n0.010447 0.510446 0.499999 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Nb",
"F"
],
"chemical_system": "F-Na-Nb",
"density": 3.3898284603359983,
"density_atomic": 0.06383047409983669,
"volume": 93.99898848652529,
"volume_molar": 9.434585666057911,
"formula_full": "Na1 Nb1 F4",
"formula_reduced": "NaNbF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3176932549999999,
"spacegroup": 119
},
{
"id": "jvasp-65124",
"created_at": "2022-09-04T14:36:14.393511Z",
"updated_at": "2022-09-04T14:36:14.393543Z",
"structure_string": "La1 Be1 Cl4\n1.0\n0.000000 4.140243 4.140243\n4.140243 0.000000 4.140243\n4.140243 4.140243 -0.000000\nLa Be Cl\n1 1 4\ndirect\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Be\n0.125530 0.624823 0.624823 Cl\n0.624823 0.624823 0.624823 Cl\n0.624823 0.125530 0.624823 Cl\n0.624823 0.624823 0.125530 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Be",
"Cl"
],
"chemical_system": "Be-Cl-La",
"density": 3.3894915212283614,
"density_atomic": 0.04227112049832788,
"volume": 141.94087900360583,
"volume_molar": 14.246465882630714,
"formula_full": "La1 Be1 Cl4",
"formula_reduced": "LaBeCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.704992895,
"spacegroup": 216
},
{
"id": "jvasp-52766",
"created_at": "2022-09-04T14:37:36.923628Z",
"updated_at": "2022-09-04T14:37:36.923649Z",
"structure_string": "Li1 Mn3 Al2 H6 O12\n1.0\n5.030389 -0.037320 0.010987\n-2.482786 4.375112 0.010761\n-0.869362 -1.479678 9.465502\nLi Mn Al H O\n1 3 2 6 12\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.666599 0.333401 0.000000 Mn\n0.333400 0.666599 0.000000 Mn\n0.166668 0.833332 0.500000 Al\n0.833332 0.166667 0.500000 Al\n0.569583 0.917417 0.708940 H\n0.917422 0.569584 0.708941 H\n0.221830 0.221829 0.708930 H\n0.430416 0.082582 0.291060 H\n0.778170 0.778170 0.291070 H\n0.082577 0.430415 0.291059 H\n0.299047 0.299046 0.897397 O\n0.823732 0.823731 0.394981 O\n0.700952 0.700953 0.102603 O\n0.465032 0.106321 0.394972 O\n0.367495 0.034040 0.102584 O\n0.106319 0.465031 0.394973 O\n0.034039 0.367495 0.102584 O\n0.965961 0.632504 0.897416 O\n0.893680 0.534968 0.605027 O\n0.632504 0.965959 0.897416 O\n0.534967 0.893678 0.605028 O\n0.176268 0.176268 0.605019 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Li",
"Mn",
"Al",
"H",
"O"
],
"chemical_system": "Al-H-Li-Mn-O",
"density": 3.389419124499057,
"density_atomic": 0.11560292990429566,
"volume": 207.60719490300903,
"volume_molar": 5.209332293727813,
"formula_full": "Li1 Mn3 Al2 H6 O12",
"formula_reduced": "LiMn3Al2(HO2)6",
"formula_anonymous": "AB2C3D6E12",
"energy_above_hull": 3.1697112218390804,
"spacegroup": 12
},
{
"id": "jvasp-69533",
"created_at": "2022-09-04T14:36:13.941214Z",
"updated_at": "2022-09-04T14:36:13.941235Z",
"structure_string": "Ca4 Ta1 Be1\n1.0\n-0.000000 4.410687 4.410687\n4.410687 0.000000 4.410687\n4.410687 4.410687 0.000000\nCa Ta Be\n4 1 1\ndirect\n0.125685 0.624772 0.624772 Ca\n0.624772 0.624772 0.624772 Ca\n0.624772 0.125685 0.624772 Ca\n0.624772 0.624772 0.125685 Ca\n0.250000 0.250000 0.250000 Ta\n0.000000 0.000000 0.000000 Be\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Ta",
"Be"
],
"chemical_system": "Be-Ca-Ta",
"density": 3.389267772055661,
"density_atomic": 0.03496250455231158,
"volume": 171.61241955714826,
"volume_molar": 17.224569112288727,
"formula_full": "Ca4 Ta1 Be1",
"formula_reduced": "Ca4TaBe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.4521428300000006,
"spacegroup": 216
},
{
"id": "jvasp-25186",
"created_at": "2022-09-04T14:38:29.122815Z",
"updated_at": "2022-09-04T14:38:29.122832Z",
"structure_string": "P2\n1.0\n3.299155 -1.226702 4.273387\n-1.599475 1.084281 1.546012\n-1.716349 -1.684283 -0.594360\nP\n2\ndirect\n0.251905 0.985029 0.752867 P\n0.752219 0.985022 0.253217 P\n",
"nsites": 2,
"nelements": 1,
"elements": [
"P"
],
"chemical_system": "P",
"density": 3.3892240401444167,
"density_atomic": 0.06589572246335126,
"volume": 30.350983724509966,
"volume_molar": 9.138894809673404,
"formula_full": "P2",
"formula_reduced": "P",
"formula_anonymous": "A",
"energy_above_hull": 0.1544599999999998,
"spacegroup": 221
},
{
"id": "jvasp-100904",
"created_at": "2022-09-04T14:37:09.112301Z",
"updated_at": "2022-09-04T14:37:09.112328Z",
"structure_string": "K2 Sc1 Ag1 F6\n1.0\n5.374814 -0.000000 3.103150\n1.791605 5.067423 3.103150\n-0.000000 -0.000000 6.206301\nK Sc Ag F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.749999 0.750000 0.750001 K\n0.000000 0.000000 0.000000 Sc\n0.499999 0.500000 0.500000 Ag\n0.229388 0.229389 0.770611 F\n0.229388 0.770611 0.770612 F\n0.770610 0.770611 0.229389 F\n0.229388 0.770611 0.229389 F\n0.770610 0.229389 0.770612 F\n0.770610 0.229389 0.229389 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Sc",
"Ag",
"F"
],
"chemical_system": "Ag-F-K-Sc",
"density": 3.389212284723382,
"density_atomic": 0.05915842013615232,
"volume": 169.0376446325837,
"volume_molar": 10.179684897162776,
"formula_full": "K2 Sc1 Ag1 F6",
"formula_reduced": "K2ScAgF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-117525",
"created_at": "2022-09-04T14:38:45.927892Z",
"updated_at": "2022-09-04T14:38:45.927912Z",
"structure_string": "Ba1 Cd1 Br1\n1.0\n4.153340 0.000000 0.000000\n0.000000 4.153340 0.000000\n0.000000 0.000000 9.362842\nBa Cd Br\n1 1 1\ndirect\n0.000000 0.000000 0.380497 Ba\n0.000000 0.000000 0.001330 Cd\n0.000000 0.000000 0.697348 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Br"
],
"chemical_system": "Ba-Br-Cd",
"density": 3.3891358220165397,
"density_atomic": 0.018574562387676737,
"volume": 161.51120749904422,
"volume_molar": 32.421440862560395,
"formula_full": "Ba1 Cd1 Br1",
"formula_reduced": "BaCdBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1469666666666667,
"spacegroup": 99
},
{
"id": "jvasp-48052",
"created_at": "2022-09-04T14:37:54.207539Z",
"updated_at": "2022-09-04T14:37:54.207561Z",
"structure_string": "Li4 Mn4 F16\n1.0\n4.504509 -0.000000 0.000000\n0.000000 5.306791 0.000000\n0.000000 0.000000 11.303804\nLi Mn F\n4 4 16\ndirect\n0.000000 0.250000 0.330217 Li\n0.000000 0.750000 0.669783 Li\n0.500000 0.750000 0.169783 Li\n0.500000 0.250000 0.830217 Li\n0.000000 0.250000 0.074045 Mn\n0.000000 0.750000 0.925954 Mn\n0.500000 0.750000 0.425954 Mn\n0.500000 0.250000 0.574045 Mn\n0.225984 0.600749 0.810836 F\n0.225984 0.100749 0.189163 F\n0.274016 0.600749 0.310836 F\n0.274016 0.100749 0.689163 F\n0.263264 0.604590 0.547497 F\n0.263264 0.104590 0.452503 F\n0.736736 0.395410 0.452503 F\n0.774017 0.899251 0.810836 F\n0.725984 0.399251 0.689163 F\n0.725984 0.899251 0.310836 F\n0.236736 0.604590 0.047497 F\n0.774017 0.399251 0.189163 F\n0.763265 0.395410 0.952503 F\n0.763265 0.895410 0.047497 F\n0.736736 0.895410 0.547497 F\n0.236736 0.104590 0.952503 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.389090569431682,
"density_atomic": 0.08881926608319546,
"volume": 270.2116450446643,
"volume_molar": 6.780219006042187,
"formula_full": "Li4 Mn4 F16",
"formula_reduced": "LiMnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.348911395229885,
"spacegroup": 60
}
]
}