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=3829",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=3827",
"results": [
{
"id": "jvasp-121027",
"created_at": "2022-09-04T14:38:54.004912Z",
"updated_at": "2022-09-04T14:38:54.004948Z",
"structure_string": "S1 O1 F1\n1.0\n3.683171 -0.000000 -0.000000\n-1.841585 3.189719 0.000000\n0.000000 -0.000000 2.782873\nS O F\n1 1 1\ndirect\n0.666665 0.333333 0.000000 S\n0.333331 0.666666 0.000000 O\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"S",
"O",
"F"
],
"chemical_system": "F-O-S",
"density": 3.4061447904349516,
"density_atomic": 0.0917600327092885,
"volume": 32.69397265260916,
"volume_molar": 6.562923510586765,
"formula_full": "S1 O1 F1",
"formula_reduced": "SOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2758645941666669,
"spacegroup": 187
},
{
"id": "jvasp-11604",
"created_at": "2022-09-04T14:37:18.825438Z",
"updated_at": "2022-09-04T14:37:18.825461Z",
"structure_string": "Mn2 Al2 F10\n1.0\n3.617514 0.000000 0.000000\n-1.808758 4.974750 0.000000\n0.000000 0.000000 9.585113\nMn Al F\n2 2 10\ndirect\n0.499999 -0.000000 0.500000 Mn\n0.499999 -0.000000 0.000000 Mn\n0.794269 0.588540 0.250000 Al\n0.205730 0.411460 0.750000 Al\n0.305522 0.611045 0.250000 F\n0.694476 0.388955 0.750000 F\n0.072414 0.144829 0.615116 F\n0.927584 0.855171 0.384884 F\n0.330870 0.661742 0.884331 F\n0.669128 0.338258 0.115668 F\n0.669128 0.338258 0.384332 F\n0.330870 0.661742 0.615668 F\n0.072414 0.144829 0.884884 F\n0.927584 0.855171 0.115116 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"Al",
"F"
],
"chemical_system": "Al-F-Mn",
"density": 3.4060944294124282,
"density_atomic": 0.08116136027523332,
"volume": 172.49587676356566,
"volume_molar": 7.419960359927184,
"formula_full": "Mn2 Al2 F10",
"formula_reduced": "MnAlF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.3927359219827585,
"spacegroup": 63
},
{
"id": "jvasp-105295",
"created_at": "2022-09-04T14:36:56.295121Z",
"updated_at": "2022-09-04T14:36:56.295131Z",
"structure_string": "Rb3 Nd1 F6\n1.0\n6.211025 0.139612 -3.313182\n-2.174791 5.819502 -3.313182\n-0.094562 -0.139612 7.038826\nRb Nd F\n3 1 6\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500001 Rb\n0.500000 0.500000 -0.000000 Rb\n0.000000 0.000000 0.000000 Nd\n0.000000 0.315246 0.315246 F\n0.000000 0.684755 0.684755 F\n0.315245 0.000000 0.315246 F\n0.684754 0.000000 0.684755 F\n0.236397 0.236397 -0.000000 F\n0.763602 0.763602 -0.000000 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Nd",
"F"
],
"chemical_system": "F-Nd-Rb",
"density": 3.4060624880547508,
"density_atomic": 0.03985689876657921,
"volume": 250.8975938786586,
"volume_molar": 15.109406266825966,
"formula_full": "Rb3 Nd1 F6",
"formula_reduced": "Rb3NdF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-20946",
"created_at": "2022-09-04T14:38:30.487477Z",
"updated_at": "2022-09-04T14:38:30.487485Z",
"structure_string": "Pr8 P8 S32\n1.0\n9.829383 -0.000000 -4.822141\n-2.365667 9.540460 -4.822141\n0.016312 0.020852 12.462358\nPr P S\n8 8 32\ndirect\n0.125000 0.375000 0.250000 Pr\n0.874999 0.625000 0.750000 Pr\n0.624999 0.875000 0.250000 Pr\n0.374999 0.625000 0.750000 Pr\n0.625000 0.375000 0.250000 Pr\n0.125000 0.875000 0.250000 Pr\n0.874999 0.125000 0.750000 Pr\n0.375000 0.125000 0.750000 Pr\n0.287292 0.250000 0.500000 P\n0.787292 0.250000 0.500000 P\n0.750000 0.787292 -0.000000 P\n0.250000 0.712708 -0.000000 P\n0.712707 0.750000 0.500000 P\n0.212707 0.750000 0.500000 P\n0.250000 0.212708 -0.000000 P\n0.750000 0.287292 -0.000000 P\n0.905740 0.886895 0.996046 S\n0.334351 0.906153 0.172643 S\n0.094259 0.113105 0.003954 S\n0.390848 0.094259 0.503954 S\n0.113105 0.909695 0.503954 S\n0.109151 0.590305 0.496046 S\n0.405741 0.109151 0.996046 S\n0.733509 0.661707 0.327356 S\n0.386894 0.405741 0.496046 S\n0.909695 0.390849 0.003954 S\n0.590304 0.386895 0.996046 S\n0.593847 0.165649 0.327356 S\n0.661707 0.593847 0.827356 S\n0.165648 0.733509 0.827356 S\n0.609151 0.905741 0.496046 S\n0.886894 0.090305 0.496046 S\n0.409695 0.613105 0.003954 S\n0.594258 0.890849 0.003954 S\n0.890848 0.409695 0.503954 S\n0.613105 0.594259 0.503954 S\n0.161707 0.233509 0.827356 S\n0.090304 0.609151 0.996046 S\n0.093847 0.161707 0.327357 S\n0.834351 0.266491 0.172643 S\n0.338292 0.406153 0.172643 S\n0.406152 0.834351 0.672643 S\n0.266490 0.338292 0.672643 S\n0.838292 0.766491 0.172643 S\n0.906152 0.838292 0.672643 S\n0.766490 0.334351 0.672643 S\n0.233509 0.665649 0.327356 S\n0.665649 0.093847 0.827356 S\n",
"nsites": 48,
"nelements": 3,
"elements": [
"Pr",
"P",
"S"
],
"chemical_system": "P-Pr-S",
"density": 3.40592655797048,
"density_atomic": 0.041002610777499816,
"volume": 1170.6571627955946,
"volume_molar": 14.687212950119386,
"formula_full": "Pr8 P8 S32",
"formula_reduced": "PrPS4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.072474225,
"spacegroup": 142
},
{
"id": "jvasp-120300",
"created_at": "2022-09-04T14:38:47.312758Z",
"updated_at": "2022-09-04T14:38:47.312785Z",
"structure_string": "Rb1 Al1 N1\n1.0\n4.907712 -0.000000 -0.000000\n-2.453856 4.250204 0.000000\n0.000000 0.000000 2.955837\nRb Al N\n1 1 1\ndirect\n0.666665 0.333333 0.000000 Rb\n0.000000 0.000000 0.000000 Al\n0.333332 0.666666 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Al",
"N"
],
"chemical_system": "Al-N-Rb",
"density": 3.4058015942235276,
"density_atomic": 0.048657739484497135,
"volume": 61.655145343441845,
"volume_molar": 12.376532127882179,
"formula_full": "Rb1 Al1 N1",
"formula_reduced": "RbAlN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.219758683333333,
"spacegroup": 187
},
{
"id": "jvasp-91250",
"created_at": "2022-09-04T14:35:55.587377Z",
"updated_at": "2022-09-04T14:35:55.587410Z",
"structure_string": "Na8 Be4 Ge4 O16\n1.0\n5.041269 0.000000 0.000000\n0.000000 7.284638 -0.040596\n0.000000 -0.005757 10.176962\nNa Be Ge O\n8 4 4 16\ndirect\n0.182920 0.739225 0.638100 Na\n0.682921 0.260775 0.861899 Na\n0.817080 0.260775 0.361900 Na\n0.317080 0.739225 0.138100 Na\n0.291187 0.001018 0.391125 Na\n0.791187 0.998982 0.108874 Na\n0.708813 0.998982 0.608874 Na\n0.208813 0.001018 0.891125 Na\n0.656957 0.499481 0.587042 Be\n0.343043 0.500519 0.412958 Be\n0.843043 0.499481 0.087042 Be\n0.156957 0.500518 0.912958 Be\n0.656134 0.721586 0.839908 Ge\n0.156134 0.278413 0.660091 Ge\n0.843867 0.721587 0.339909 Ge\n0.343867 0.278414 0.160090 Ge\n0.238819 0.049872 0.621917 O\n0.738819 0.950128 0.878082 O\n0.761181 0.950128 0.378082 O\n0.261181 0.049872 0.121917 O\n0.780000 0.686408 0.168349 O\n0.280000 0.313592 0.331650 O\n0.690033 0.311686 0.127326 O\n0.809967 0.311686 0.627326 O\n0.190033 0.688314 0.372674 O\n0.309967 0.688314 0.872674 O\n0.329423 0.456036 0.574713 O\n0.829423 0.543964 0.925286 O\n0.670577 0.543964 0.425286 O\n0.170577 0.456036 0.074713 O\n0.720000 0.686408 0.668349 O\n0.220000 0.313591 0.831650 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Na",
"Be",
"Ge",
"O"
],
"chemical_system": "Be-Ge-Na-O",
"density": 3.4057002244530206,
"density_atomic": 0.08562199598755334,
"volume": 373.7357396416192,
"volume_molar": 7.033403847389196,
"formula_full": "Na8 Be4 Ge4 O16",
"formula_reduced": "Na2BeGeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.30595050625,
"spacegroup": 14
},
{
"id": "jvasp-110702",
"created_at": "2022-09-04T14:38:38.385399Z",
"updated_at": "2022-09-04T14:38:38.385419Z",
"structure_string": "Rb2 Ag1 Sb1 Cl6\n1.0\n6.500365 -0.000000 3.752988\n2.166788 6.128603 3.752988\n-0.000000 -0.000000 7.505975\nRb Ag Sb Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Sb\n0.750385 0.249615 0.249615 Cl\n0.249616 0.249615 0.750385 Cl\n0.249616 0.750384 0.750385 Cl\n0.249616 0.750384 0.249616 Cl\n0.750385 0.249615 0.750385 Cl\n0.750386 0.750384 0.249616 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"Sb",
"Cl"
],
"chemical_system": "Ag-Cl-Rb-Sb",
"density": 3.4056720704498606,
"density_atomic": 0.033442108664788875,
"volume": 299.0242062854421,
"volume_molar": 18.007658608982094,
"formula_full": "Rb2 Ag1 Sb1 Cl6",
"formula_reduced": "Rb2AgSbCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-98880",
"created_at": "2022-09-04T14:35:49.238195Z",
"updated_at": "2022-09-04T14:35:49.238213Z",
"structure_string": "Ba4 Al4 H20\n1.0\n9.207352 0.000000 0.000000\n0.000000 7.042981 0.000000\n0.000000 0.000000 5.094183\nBa Al H\n4 4 20\ndirect\n0.186008 0.345454 0.253997 Ba\n0.813991 0.654545 0.753997 Ba\n0.313991 0.845454 0.753997 Ba\n0.686008 0.154545 0.253997 Ba\n0.540951 0.654210 0.228981 Al\n0.459049 0.345790 0.728981 Al\n0.959048 0.154210 0.728981 Al\n0.040951 0.845790 0.228981 Al\n0.578307 0.788084 0.501913 H\n0.859346 0.803876 0.234459 H\n0.140654 0.196124 0.734459 H\n0.793695 0.043971 0.714497 H\n0.359346 0.696124 0.234459 H\n0.206305 0.956029 0.214497 H\n0.421693 0.211915 0.001913 H\n0.640654 0.303876 0.734459 H\n0.921693 0.288084 0.001913 H\n0.916271 0.343605 0.523827 H\n0.583729 0.843605 0.023828 H\n0.416271 0.156395 0.523827 H\n0.293695 0.456029 0.714497 H\n0.083729 0.656395 0.023828 H\n0.007157 0.948692 0.909324 H\n0.992843 0.051307 0.409324 H\n0.492843 0.448692 0.409324 H\n0.507157 0.551307 0.909324 H\n0.078307 0.711915 0.501913 H\n0.706305 0.543971 0.214497 H\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ba",
"Al",
"H"
],
"chemical_system": "Al-Ba-H",
"density": 3.405053712328238,
"density_atomic": 0.08476024934965735,
"volume": 330.34353030856425,
"volume_molar": 7.104911566691072,
"formula_full": "Ba4 Al4 H20",
"formula_reduced": "BaAlH5",
"formula_anonymous": "ABC5",
"energy_above_hull": 2.2685741100000003,
"spacegroup": 33
},
{
"id": "jvasp-30139",
"created_at": "2022-09-04T14:38:05.266836Z",
"updated_at": "2022-09-04T14:38:05.266866Z",
"structure_string": "In4 H20 N8 F8\n1.0\n7.737236 0.000000 -0.793518\n0.000000 5.410786 0.000000\n-0.055156 0.000000 8.666691\nIn H N F\n4 20 8 8\ndirect\n0.639428 0.572631 0.354633 In\n0.139427 0.927370 0.854633 In\n0.360573 0.427370 0.645367 In\n0.860573 0.072631 0.145367 In\n0.110185 0.363437 0.337681 H\n0.610185 0.136563 0.837681 H\n0.889815 0.636564 0.662319 H\n0.389815 0.863437 0.162319 H\n0.691523 0.247218 0.679182 H\n0.808477 0.747218 0.820817 H\n0.308477 0.752783 0.320817 H\n0.062529 0.495927 0.166341 H\n0.562530 0.004073 0.666341 H\n0.191523 0.252782 0.179183 H\n0.437471 0.995928 0.333659 H\n0.683420 0.495677 0.063381 H\n0.183420 0.004323 0.563381 H\n0.316580 0.504323 0.936619 H\n0.816580 0.995678 0.436618 H\n0.542782 0.281968 0.103805 H\n0.042781 0.218032 0.603805 H\n0.457218 0.718032 0.896195 H\n0.957219 0.781969 0.396195 H\n0.937471 0.504073 0.833658 H\n0.083407 0.326721 0.221150 N\n0.583407 0.173280 0.721150 N\n0.916593 0.673280 0.778849 N\n0.416593 0.826721 0.278850 N\n0.161019 0.140312 0.642570 N\n0.338981 0.640312 0.857429 N\n0.838981 0.859689 0.357429 N\n0.661019 0.359689 0.142570 N\n0.184463 0.655973 0.498018 F\n0.561004 0.694157 0.585592 F\n0.061004 0.805844 0.085592 F\n0.438997 0.305844 0.414407 F\n0.938997 0.194156 0.914407 F\n0.815537 0.344028 0.501982 F\n0.315537 0.155972 0.001982 F\n0.684463 0.844029 0.998018 F\n",
"nsites": 40,
"nelements": 4,
"elements": [
"In",
"H",
"N",
"F"
],
"chemical_system": "F-H-In-N",
"density": 3.404846490314347,
"density_atomic": 0.11031740355338118,
"volume": 362.5901146290532,
"volume_molar": 5.458921771201734,
"formula_full": "In4 H20 N8 F8",
"formula_reduced": "InH5(NF)2",
"formula_anonymous": "AB2C2D5",
"energy_above_hull": 2.5824807034999995,
"spacegroup": 14
},
{
"id": "jvasp-42790",
"created_at": "2022-09-04T14:36:17.406755Z",
"updated_at": "2022-09-04T14:36:17.406785Z",
"structure_string": "Li4 Co2 O1 F7\n1.0\n-4.168579 4.168579 0.017934\n4.114457 -0.036457 4.217276\n4.077999 4.077999 -0.000000\nLi Co O F\n4 2 1 7\ndirect\n0.006883 -0.000495 0.000248 Li\n0.255142 0.523198 0.238401 Li\n0.625929 0.744739 0.627631 Li\n0.113262 0.742441 0.628780 Li\n0.637546 0.250092 0.153879 Co\n0.637546 0.250092 0.596028 Co\n0.862559 0.242110 0.378945 O\n0.355559 0.232527 0.383737 F\n0.854491 0.721661 0.397937 F\n0.872868 0.263009 0.868495 F\n0.412545 0.256247 0.871877 F\n0.854491 0.721661 0.880403 F\n0.380588 0.776359 0.378202 F\n0.380588 0.776359 0.845440 F\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"O",
"F"
],
"chemical_system": "Co-F-Li-O",
"density": 3.4048154003151017,
"density_atomic": 0.09743440314105145,
"volume": 143.68641412759334,
"volume_molar": 6.1807129369715685,
"formula_full": "Li4 Co2 O1 F7",
"formula_reduced": "Li4Co2OF7",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 0.7715240912500002,
"spacegroup": 8
},
{
"id": "jvasp-7737",
"created_at": "2022-09-04T14:36:44.360281Z",
"updated_at": "2022-09-04T14:36:44.360309Z",
"structure_string": "Li2 Mg1 In1\n1.0\n4.092547 0.000000 2.362833\n1.364182 3.858489 2.362833\n0.000000 0.000000 4.725665\nLi Mg In\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Li\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"In"
],
"chemical_system": "In-Li-Mg",
"density": 3.4047156504401883,
"density_atomic": 0.053602632337012256,
"volume": 74.62320086914886,
"volume_molar": 11.23478548989422,
"formula_full": "Li2 Mg1 In1",
"formula_reduced": "Li2MgIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2031366666666667,
"spacegroup": 225
},
{
"id": "jvasp-42669",
"created_at": "2022-09-04T14:36:15.432348Z",
"updated_at": "2022-09-04T14:36:15.432375Z",
"structure_string": "Na8 Sn1 O6\n1.0\n6.309540 0.000001 0.000000\n-3.154770 1.821406 5.639931\n3.154771 -5.464221 -0.000000\nNa Sn O\n8 1 6\ndirect\n0.340834 0.022503 0.340834 Na\n0.093257 0.346683 0.499289 Na\n0.245862 0.653317 0.906743 Na\n0.500711 0.653317 0.245861 Na\n0.499290 0.346683 0.754138 Na\n0.754139 0.346683 0.093256 Na\n0.906744 0.653317 0.500710 Na\n0.659166 0.977497 0.659165 Na\n0.000000 0.000000 0.000000 Sn\n0.221345 0.781059 0.646819 O\n0.353180 0.218941 0.087106 O\n0.087106 0.218941 0.778655 O\n0.912894 0.781059 0.221345 O\n0.646820 0.781059 0.912893 O\n0.778655 0.218941 0.353180 O\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Na",
"Sn",
"O"
],
"chemical_system": "Na-O-Sn",
"density": 3.404186613410306,
"density_atomic": 0.07714210307027283,
"volume": 194.44634516038155,
"volume_molar": 7.80655507215575,
"formula_full": "Na8 Sn1 O6",
"formula_reduced": "Na8SnO6",
"formula_anonymous": "AB6C8",
"energy_above_hull": 0.6597676466666668,
"spacegroup": 148
}
]
}