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_molar&page=3589",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=3587",
"results": [
{
"id": "jvasp-41842",
"created_at": "2022-09-04T14:37:34.063553Z",
"updated_at": "2022-09-04T14:37:34.063572Z",
"structure_string": "Al1 Fe2 W1\n1.0\n0.000105 2.925319 2.925319\n2.925319 0.000105 2.925319\n2.925319 2.925319 0.000105\nAl Fe W\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.000005 0.000005 0.000005 Fe\n0.499996 0.499996 0.499996 Fe\n0.750001 0.750001 0.750001 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Fe",
"W"
],
"chemical_system": "Al-Fe-W",
"density": 10.697149030753538,
"density_atomic": 0.0798975906360424,
"volume": 50.064087892477325,
"volume_molar": 7.537324607737755,
"formula_full": "Al1 Fe2 W1",
"formula_reduced": "AlFe2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.04493345,
"spacegroup": 225
},
{
"id": "jvasp-34818",
"created_at": "2022-09-04T14:37:09.683366Z",
"updated_at": "2022-09-04T14:37:09.683390Z",
"structure_string": "Ni1 Pb2 N6 O12\n1.0\n6.226771 0.000000 3.595028\n2.075590 5.870656 3.595028\n-0.000000 -0.000000 7.190056\nNi Pb N O\n1 2 6 12\ndirect\n0.000000 0.000000 0.000000 Ni\n0.249999 0.250001 0.250000 Pb\n0.750000 0.750002 0.750001 Pb\n0.187627 0.187626 0.812374 N\n0.187626 0.812374 0.812374 N\n0.812374 0.187626 0.187627 N\n0.812374 0.187626 0.812374 N\n0.187626 0.812374 0.187627 N\n0.812372 0.812374 0.187627 N\n0.658603 -0.000000 0.000000 O\n0.999999 0.000000 0.658603 O\n0.658602 0.000000 0.341397 O\n0.341398 -0.000000 0.000000 O\n0.341397 0.658603 0.000001 O\n0.000001 0.341398 0.658604 O\n0.000001 0.658603 0.341397 O\n0.000001 0.341398 1.000000 O\n0.341397 0.000000 0.658604 O\n0.658603 0.341398 0.000000 O\n0.000000 0.000000 0.341397 O\n0.000001 0.658603 0.000001 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Ni",
"Pb",
"N",
"O"
],
"chemical_system": "N-Ni-O-Pb",
"density": 4.732846287945478,
"density_atomic": 0.07989829187401708,
"volume": 262.83415461637924,
"volume_molar": 7.537258455406855,
"formula_full": "Ni1 Pb2 N6 O12",
"formula_reduced": "NiPb2(NO2)6",
"formula_anonymous": "AB2C6D12",
"energy_above_hull": 3.7595902638095233,
"spacegroup": 225
},
{
"id": "jvasp-117233",
"created_at": "2022-09-04T14:38:49.506452Z",
"updated_at": "2022-09-04T14:38:49.506484Z",
"structure_string": "Er4 Sb4 O16\n1.0\n5.338699 -0.000000 0.000000\n0.000000 7.412323 1.132756\n-0.000000 -0.069881 7.579661\nEr Sb O\n4 4 16\ndirect\n0.726581 0.388011 0.356780 Er\n0.273419 0.611989 0.643220 Er\n0.773419 0.888011 0.356780 Er\n0.226581 0.111989 0.643220 Er\n0.769644 0.809725 0.836714 Sb\n0.230356 0.190275 0.163287 Sb\n0.269644 0.690275 0.163287 Sb\n0.730356 0.309725 0.836713 Sb\n0.489333 0.882992 0.674661 O\n0.510667 0.117008 0.325339 O\n0.520174 0.326801 0.611253 O\n0.479827 0.673199 0.388747 O\n0.020173 0.173199 0.388747 O\n0.979827 0.826801 0.611253 O\n0.402768 0.187816 0.928681 O\n0.610787 0.564034 0.829959 O\n0.889213 0.064034 0.829958 O\n0.110787 0.935966 0.170042 O\n0.989333 0.617008 0.325340 O\n0.389213 0.435966 0.170042 O\n0.097232 0.687816 0.928681 O\n0.902768 0.312184 0.071319 O\n0.597232 0.812183 0.071320 O\n0.010667 0.382992 0.674661 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Er",
"Sb",
"O"
],
"chemical_system": "Er-O-Sb",
"density": 7.80644312851489,
"density_atomic": 0.07990247377222082,
"volume": 300.3661697435947,
"volume_molar": 7.536863973908252,
"formula_full": "Er4 Sb4 O16",
"formula_reduced": "ErSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8988316833333336,
"spacegroup": 14
},
{
"id": "jvasp-47105",
"created_at": "2022-09-04T14:38:04.360486Z",
"updated_at": "2022-09-04T14:38:04.360497Z",
"structure_string": "Li1 Mn1 P1 O4\n1.0\n0.000000 4.825903 -0.000000\n2.412950 -2.412950 3.761581\n4.825903 -0.000000 0.000000\nLi Mn P O\n1 1 1 4\ndirect\n0.500000 -0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.750000 0.500000 0.750000 P\n0.451534 0.264231 0.060983 O\n0.674788 0.735769 0.451534 O\n0.812697 0.264231 0.674788 O\n0.060983 0.735769 0.812697 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 2.9730838135983366,
"density_atomic": 0.0799043540643659,
"volume": 87.60473796410696,
"volume_molar": 7.536686618039542,
"formula_full": "Li1 Mn1 P1 O4",
"formula_reduced": "LiMnPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.547000963054187,
"spacegroup": 82
},
{
"id": "jvasp-108958",
"created_at": "2022-09-04T14:38:28.003139Z",
"updated_at": "2022-09-04T14:38:28.003150Z",
"structure_string": "Ti1 Zn1 F6\n1.0\n4.529659 0.096697 2.976198\n1.655128 4.217548 2.976198\n0.138622 0.096697 5.418150\nTi Zn F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500001 0.500000 Zn\n0.628281 0.893367 0.238989 F\n0.893365 0.238990 0.628281 F\n0.761011 0.371720 0.106634 F\n0.106634 0.761012 0.371719 F\n0.371718 0.106635 0.761011 F\n0.238988 0.628282 0.893366 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"F"
],
"chemical_system": "F-Ti-Zn",
"density": 3.7695468473377107,
"density_atomic": 0.07990882877931776,
"volume": 100.11409405202775,
"volume_molar": 7.536264580514874,
"formula_full": "Ti1 Zn1 F6",
"formula_reduced": "TiZnF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-98366",
"created_at": "2022-09-04T14:35:58.658141Z",
"updated_at": "2022-09-04T14:35:58.658164Z",
"structure_string": "Bi2 P8 H2 O24\n1.0\n6.568346 -0.003359 -2.661646\n-3.521165 7.746035 -1.328927\n0.008659 -0.057539 8.873393\nBi P H O\n2 8 2 24\ndirect\n0.093802 0.259303 0.259153 Bi\n0.906199 0.740696 0.740846 Bi\n0.091826 0.393830 0.664194 P\n0.908175 0.606169 0.335805 P\n0.214639 0.198796 0.893907 P\n0.785362 0.801203 0.106092 P\n0.428463 0.872646 0.160043 P\n0.571538 0.127353 0.839956 P\n0.383684 0.711852 0.418336 P\n0.616317 0.288147 0.581663 P\n0.531363 0.151362 0.244083 H\n0.468638 0.848637 0.755916 H\n0.877017 0.421657 0.301327 O\n0.828828 0.262584 0.578206 O\n0.171173 0.737415 0.421793 O\n0.685700 0.458582 0.708524 O\n0.314301 0.541417 0.291475 O\n0.550649 0.759527 0.602681 O\n0.449352 0.240472 0.397318 O\n0.517937 0.133433 0.649977 O\n0.814972 0.197402 0.955204 O\n0.185029 0.802597 0.044795 O\n0.122984 0.578342 0.698672 O\n0.574514 0.065483 0.190222 O\n0.538809 0.764440 0.094318 O\n0.461192 0.235559 0.905681 O\n0.958208 0.963441 0.251006 O\n0.041793 0.036559 0.748993 O\n0.482064 0.866566 0.350022 O\n0.248179 0.213380 0.072851 O\n0.811779 0.633765 0.149835 O\n0.188222 0.366234 0.850164 O\n0.812921 0.676272 0.441383 O\n0.187080 0.323728 0.558616 O\n0.425487 0.934516 0.809777 O\n0.751822 0.786619 0.927148 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Bi",
"P",
"H",
"O"
],
"chemical_system": "Bi-H-O-P",
"density": 3.8767651165004127,
"density_atomic": 0.07991151981873792,
"volume": 450.4982520875369,
"volume_molar": 7.536010795014199,
"formula_full": "Bi2 P8 H2 O24",
"formula_reduced": "BiP4HO12",
"formula_anonymous": "ABC4D12",
"energy_above_hull": 2.981893794444444,
"spacegroup": 2
},
{
"id": "jvasp-61260",
"created_at": "2022-09-04T14:35:55.629340Z",
"updated_at": "2022-09-04T14:35:55.629364Z",
"structure_string": "Dy4 B8 Ru4\n1.0\n5.312498 0.000000 0.000000\n-0.000000 5.908853 0.000000\n0.000000 0.000000 6.378314\nDy B Ru\n4 8 4\ndirect\n0.250000 0.009940 0.661740 Dy\n0.750000 0.490059 0.161741 Dy\n0.750000 0.990059 0.338259 Dy\n0.250000 0.509940 0.838259 Dy\n0.085442 0.371725 0.462440 B\n0.914559 0.128274 0.962440 B\n0.585442 0.628274 0.537559 B\n0.414558 0.871725 0.037559 B\n0.914559 0.628274 0.537559 B\n0.085442 0.871725 0.037559 B\n0.414558 0.371725 0.462440 B\n0.585442 0.128274 0.962440 B\n0.250000 0.185195 0.183355 Ru\n0.750000 0.314804 0.683355 Ru\n0.750000 0.814804 0.816644 Ru\n0.250000 0.685195 0.316644 Ru\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Dy",
"B",
"Ru"
],
"chemical_system": "B-Dy-Ru",
"density": 9.46103320800735,
"density_atomic": 0.07991202240363572,
"volume": 200.22018613399595,
"volume_molar": 7.5359633993270245,
"formula_full": "Dy4 B8 Ru4",
"formula_reduced": "DyB2Ru",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.558683041666667,
"spacegroup": 62
},
{
"id": "jvasp-106118",
"created_at": "2022-09-04T14:35:43.214054Z",
"updated_at": "2022-09-04T14:35:43.214074Z",
"structure_string": "Ca1 U1 O4\n1.0\n3.709226 -0.000000 -0.000000\n0.000000 3.709226 -0.000000\n-0.000000 -0.000000 5.457187\nCa U O\n1 1 4\ndirect\n0.000000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 U\n0.500000 0.000000 0.775853 O\n0.000000 0.500000 0.224148 O\n0.500000 0.000000 0.224148 O\n0.000000 0.500000 0.775853 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"U",
"O"
],
"chemical_system": "Ca-O-U",
"density": 7.566106855141241,
"density_atomic": 0.07991270358161748,
"volume": 75.0819297944538,
"volume_molar": 7.53589916257731,
"formula_full": "Ca1 U1 O4",
"formula_reduced": "CaUO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2353884033333333,
"spacegroup": 123
},
{
"id": "jvasp-116949",
"created_at": "2022-09-04T14:38:48.270893Z",
"updated_at": "2022-09-04T14:38:48.270909Z",
"structure_string": "Tb2 Ni12 P7\n1.0\n9.053332 0.000000 0.000000\n-4.526666 7.840415 0.000000\n-0.000000 0.000000 3.701976\nTb Ni P\n2 12 7\ndirect\n0.666666 0.333334 -0.000000 Tb\n0.333333 0.666667 0.500001 Tb\n0.121238 0.214768 0.500001 Ni\n0.785232 0.906471 0.500001 Ni\n0.093529 0.878763 0.500001 Ni\n0.618652 0.569411 0.500001 Ni\n0.430589 0.049242 0.500001 Ni\n0.950758 0.381348 0.500001 Ni\n0.847984 0.725579 -0.000000 Ni\n0.274422 0.122406 -0.000000 Ni\n0.372433 0.433990 -0.000000 Ni\n0.566010 0.938444 -0.000000 Ni\n0.061556 0.627567 -0.000000 Ni\n0.877594 0.152016 -0.000000 Ni\n0.705180 0.109306 0.500001 P\n0.295291 0.888175 -0.000000 P\n0.592884 0.704709 -0.000000 P\n0.111825 0.407116 -0.000000 P\n0.404127 0.294820 0.500001 P\n0.890694 0.595873 0.500001 P\n0.000000 0.000000 0.000000 P\n",
"nsites": 21,
"nelements": 3,
"elements": [
"Tb",
"Ni",
"P"
],
"chemical_system": "Ni-P-Tb",
"density": 7.829518285086081,
"density_atomic": 0.0799168206726398,
"volume": 262.77321624219127,
"volume_molar": 7.53551093413521,
"formula_full": "Tb2 Ni12 P7",
"formula_reduced": "Tb2Ni12P7",
"formula_anonymous": "A2B7C12",
"energy_above_hull": 2.145363528571429,
"spacegroup": 174
},
{
"id": "jvasp-119229",
"created_at": "2022-09-04T14:38:44.126783Z",
"updated_at": "2022-09-04T14:38:44.126808Z",
"structure_string": "Ca6 Co6 N10\n1.0\n5.351411 0.003036 -1.394483\n-1.180982 6.241620 -2.170040\n-0.050933 0.010609 8.249708\nCa Co N\n6 6 10\ndirect\n0.813686 0.409470 0.610337 Ca\n0.186315 0.590531 0.389664 Ca\n0.658865 0.869401 0.872381 Ca\n0.341136 0.130600 0.127620 Ca\n0.659467 0.666362 0.199811 Ca\n0.340534 0.333639 0.800190 Ca\n0.896321 0.119304 0.288797 Co\n0.313674 0.054003 0.438766 Co\n0.103680 0.880697 0.711204 Co\n0.088035 0.679388 0.026299 Co\n0.911966 0.320613 0.973702 Co\n0.686327 0.945998 0.561235 Co\n0.231465 0.766505 0.882460 N\n0.935519 0.111885 0.777215 N\n0.064482 0.888116 0.222786 N\n0.822778 0.696564 0.511275 N\n0.177223 0.303437 0.488726 N\n0.747475 0.534592 0.903011 N\n0.252526 0.465409 0.096990 N\n0.373480 0.949359 0.625719 N\n0.626521 0.050642 0.374282 N\n0.768536 0.233496 0.117541 N\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ca",
"Co",
"N"
],
"chemical_system": "Ca-Co-N",
"density": 4.428436082782996,
"density_atomic": 0.07991872109981794,
"volume": 275.27968037078756,
"volume_molar": 7.535331743457689,
"formula_full": "Ca6 Co6 N10",
"formula_reduced": "Ca3Co3N5",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 3.721544564545455,
"spacegroup": 2
},
{
"id": "jvasp-20128",
"created_at": "2022-09-04T14:38:34.565485Z",
"updated_at": "2022-09-04T14:38:34.565512Z",
"structure_string": "C2 F8\n1.0\n4.023320 -0.000000 1.191702\n2.018920 4.183297 0.571340\n-0.013002 -0.152674 7.431339\nC F\n2 8\ndirect\n0.942732 0.250000 0.250000 C\n0.057268 0.750001 0.750000 C\n0.977994 0.501664 0.296664 F\n0.276324 -0.001664 0.203335 F\n0.022005 0.498337 0.703335 F\n0.723676 0.001664 0.796664 F\n0.279272 0.822205 0.603560 F\n0.205036 0.677797 0.896440 F\n0.720728 0.177796 0.396440 F\n0.794964 0.322204 0.103560 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
"C",
"F"
],
"chemical_system": "C-F",
"density": 2.335847749782511,
"density_atomic": 0.0799211055709802,
"volume": 125.12339423431419,
"volume_molar": 7.535106924480124,
"formula_full": "C2 F8",
"formula_reduced": "CF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.7956522260000002,
"spacegroup": 15
},
{
"id": "jvasp-8391",
"created_at": "2022-09-04T14:36:34.282285Z",
"updated_at": "2022-09-04T14:36:34.282312Z",
"structure_string": "Mg1 W1 O3\n1.0\n4.021180 0.013193 -0.039252\n-0.330123 4.007347 -0.058706\n-0.469840 -0.493123 3.893491\nMg W O\n1 1 3\ndirect\n0.520967 0.532645 0.308015 Mg\n0.966835 0.978502 0.062765 W\n-0.017792 0.478890 0.088249 O\n0.467222 -0.006125 0.088247 O\n0.949428 0.961102 0.566066 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"W",
"O"
],
"chemical_system": "Mg-O-W",
"density": 6.79869824492967,
"density_atomic": 0.07992153965024322,
"volume": 62.56135732471194,
"volume_molar": 7.535065998921447,
"formula_full": "Mg1 W1 O3",
"formula_reduced": "MgWO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.63741591,
"spacegroup": 8
}
]
}