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_atomic&page=3511",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=3509",
"results": [
{
"id": "jvasp-45563",
"created_at": "2022-09-04T14:37:13.437007Z",
"updated_at": "2022-09-04T14:37:13.437033Z",
"structure_string": "Ti8 O16\n1.0\n5.183303 0.000000 0.000000\n0.000000 5.987251 0.000000\n0.000000 0.000000 9.893183\nTi O\n8 16\ndirect\n0.493217 0.500000 0.736237 Ti\n0.493217 0.500000 0.263763 Ti\n0.506783 0.000000 0.763762 Ti\n0.506783 0.000000 0.236237 Ti\n0.000000 0.250000 0.750000 Ti\n0.000000 0.750000 0.250000 Ti\n0.000000 0.750000 0.750000 Ti\n0.000000 0.250000 0.250000 Ti\n0.333055 0.751088 0.348190 O\n0.333055 0.248912 0.651810 O\n0.333055 0.248912 0.348190 O\n0.333055 0.751088 0.651810 O\n0.666945 0.748912 0.151810 O\n0.666945 0.251088 0.848190 O\n0.832949 0.000000 0.345533 O\n0.166607 0.000000 0.150512 O\n0.167051 0.500000 0.154466 O\n0.167051 0.500000 0.845533 O\n0.666945 0.748912 0.848190 O\n0.166607 0.000000 0.849488 O\n0.833392 0.500000 0.349488 O\n0.833392 0.500000 0.650511 O\n0.832949 0.000000 0.654466 O\n0.666945 0.251088 0.151810 O\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 3.4556506099102062,
"density_atomic": 0.07817018447489694,
"volume": 307.02243011473513,
"volume_molar": 7.703884544284158,
"formula_full": "Ti8 O16",
"formula_reduced": "TiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.537238444444445,
"spacegroup": 59
},
{
"id": "jvasp-101629",
"created_at": "2022-09-04T14:36:46.231427Z",
"updated_at": "2022-09-04T14:36:46.231451Z",
"structure_string": "Mg1 Re1 Pb2 O6\n1.0\n4.897970 -0.000000 2.827844\n1.632657 4.617851 2.827844\n-0.000000 -0.000000 5.655689\nMg Re Pb O\n1 1 2 6\ndirect\n0.500000 0.500000 0.499999 Mg\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Pb\n0.750000 0.750000 0.749999 Pb\n0.758326 0.241674 0.241673 O\n0.241675 0.758326 0.758325 O\n0.241675 0.758326 0.241673 O\n0.758326 0.241674 0.758325 O\n0.241674 0.241674 0.758326 O\n0.758326 0.758326 0.241673 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Mg",
"Re",
"Pb",
"O"
],
"chemical_system": "Mg-O-Pb-Re",
"density": 9.358098815546116,
"density_atomic": 0.07817329959351749,
"volume": 127.92091483917929,
"volume_molar": 7.703577553095105,
"formula_full": "Mg1 Re1 Pb2 O6",
"formula_reduced": "MgRe(PbO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.337478969,
"spacegroup": 225
},
{
"id": "jvasp-42931",
"created_at": "2022-09-04T14:38:11.004336Z",
"updated_at": "2022-09-04T14:38:11.004363Z",
"structure_string": "Li2 Co2 Si4 O12\n1.0\n-5.140398 0.036958 0.016420\n-0.036515 -5.140423 0.017315\n2.461525 2.428307 9.665674\nLi Co Si O\n2 2 4 12\ndirect\n0.111163 0.142439 0.331516 Li\n0.892440 0.361159 0.831517 Li\n0.716996 0.228152 0.505910 Co\n0.978152 0.966995 0.005910 Co\n0.398936 0.016537 0.833551 Si\n0.299927 0.430034 0.661466 Si\n0.180035 0.549922 0.161465 Si\n0.766539 0.648936 0.333550 Si\n0.800658 0.348504 0.361259 O\n0.763570 0.868382 0.475753 O\n0.494976 0.656597 0.213106 O\n0.406602 0.744972 0.713108 O\n0.359451 0.298124 0.510172 O\n0.048126 0.609450 0.010172 O\n0.618379 0.013569 0.975754 O\n0.144627 0.234581 0.163013 O\n0.984585 0.394627 0.663013 O\n0.098503 0.050654 0.861258 O\n0.483107 0.274851 0.775540 O\n0.024856 0.733108 0.275540 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Co",
"Si",
"O"
],
"chemical_system": "Co-Li-O-Si",
"density": 2.830402102808196,
"density_atomic": 0.07817352407645597,
"volume": 255.84109500346204,
"volume_molar": 7.7035554315169055,
"formula_full": "Li2 Co2 Si4 O12",
"formula_reduced": "LiCo(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.73229791,
"spacegroup": 9
},
{
"id": "jvasp-91457",
"created_at": "2022-09-04T14:36:22.632946Z",
"updated_at": "2022-09-04T14:36:22.632970Z",
"structure_string": "Na4 Nb4 O8 F4\n1.0\n5.519374 0.000000 0.000000\n-0.000000 5.649429 0.000000\n0.000000 0.000000 8.204860\nNa Nb O F\n4 4 8 4\ndirect\n0.964140 0.024294 0.250000 Na\n0.535859 0.524294 0.250000 Na\n0.464140 0.475706 0.750000 Na\n0.035859 0.975706 0.750000 Na\n0.500000 -0.000000 0.500000 Nb\n0.500000 -0.000000 0.000000 Nb\n0.000000 0.500000 0.500000 Nb\n0.000000 0.500000 0.000000 Nb\n0.771416 0.769996 0.045439 O\n0.771416 0.769996 0.454561 O\n0.271416 0.730005 0.954561 O\n0.728583 0.269996 0.454561 O\n0.228583 0.230005 0.545439 O\n0.271416 0.730005 0.545439 O\n0.728583 0.269996 0.045439 O\n0.228583 0.230005 0.954561 O\n0.878644 0.521931 0.750000 F\n0.378644 0.978069 0.250000 F\n0.621355 0.021931 0.750000 F\n0.121355 0.478069 0.250000 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Na",
"Nb",
"O",
"F"
],
"chemical_system": "F-Na-Nb-O",
"density": 4.332938990274895,
"density_atomic": 0.07817437940217556,
"volume": 255.83829578112915,
"volume_molar": 7.70347114496237,
"formula_full": "Na4 Nb4 O8 F4",
"formula_reduced": "NaNbO2F",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.5007071364999998,
"spacegroup": 62
},
{
"id": "jvasp-101855",
"created_at": "2022-09-04T14:37:13.095276Z",
"updated_at": "2022-09-04T14:37:13.095307Z",
"structure_string": "H2 C4 S2 N2 O4\n1.0\n4.616567 0.011067 0.531423\n0.946582 5.993122 2.045002\n-0.092777 -0.053849 6.446713\nH C S N O\n2 4 2 2 4\ndirect\n0.431495 0.188086 0.596748 H\n0.431547 0.688087 0.096738 H\n0.915271 0.242000 0.718390 C\n0.629726 0.248191 0.851811 C\n0.915317 0.742007 0.218376 C\n0.629772 0.748192 0.351802 C\n0.599513 0.276588 0.098853 S\n0.599559 0.776580 0.598846 S\n0.411001 0.234663 0.737259 N\n0.411048 0.734670 0.237244 N\n0.949106 0.249159 0.527200 O\n0.949147 0.749182 0.027185 O\n0.139425 0.728085 0.348713 O\n0.139377 0.228093 0.848722 O\n",
"nsites": 14,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.9120889657253952,
"density_atomic": 0.07818060853299391,
"volume": 179.07253809736844,
"volume_molar": 7.702857361948681,
"formula_full": "H2 C4 S2 N2 O4",
"formula_reduced": "HC2SNO2",
"formula_anonymous": "ABCD2E2",
"energy_above_hull": 4.297761464285714,
"spacegroup": 1
},
{
"id": "jvasp-34336",
"created_at": "2022-09-04T14:37:18.387668Z",
"updated_at": "2022-09-04T14:37:18.387698Z",
"structure_string": "Na2 S2 O8\n1.0\n4.789547 0.010722 -0.000714\n-0.735744 5.540584 0.008610\n-1.382940 -1.403963 5.779927\nNa S O\n2 2 8\ndirect\n0.033263 0.313276 0.208903 Na\n0.966739 0.686724 0.791098 Na\n0.610983 0.777589 0.244603 S\n0.389018 0.222411 0.755398 S\n0.771435 0.894937 0.107239 O\n0.228566 0.105063 0.892762 O\n0.579581 0.037754 0.414991 O\n0.228558 0.359814 0.607502 O\n0.420421 0.962246 0.585010 O\n0.316396 0.649424 0.124503 O\n0.771444 0.640186 0.392499 O\n0.683606 0.350576 0.875498 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"S",
"O"
],
"chemical_system": "Na-O-S",
"density": 2.576141960123497,
"density_atomic": 0.07818688330585037,
"volume": 153.47842876737477,
"volume_molar": 7.702239180506369,
"formula_full": "Na2 S2 O8",
"formula_reduced": "NaSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.7540305000000005,
"spacegroup": 2
},
{
"id": "jvasp-23562",
"created_at": "2022-09-04T14:37:33.433590Z",
"updated_at": "2022-09-04T14:37:33.433622Z",
"structure_string": "Ta4 Fe4 P4\n1.0\n3.598646 -0.000000 0.000000\n0.000000 6.134760 0.000000\n0.000000 0.000000 6.951997\nTa Fe P\n4 4 4\ndirect\n0.250000 0.522015 0.676237 Ta\n0.250000 0.022015 0.823763 Ta\n0.750001 0.977985 0.176237 Ta\n0.750001 0.477985 0.323763 Ta\n0.750001 0.357882 0.936531 Fe\n0.250000 0.142118 0.436530 Fe\n0.750001 0.857882 0.563470 Fe\n0.250000 0.642118 0.063470 Fe\n0.250000 0.777003 0.380756 P\n0.250000 0.277003 0.119244 P\n0.750001 0.222997 0.619244 P\n0.750001 0.722997 0.880757 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ta",
"Fe",
"P"
],
"chemical_system": "Fe-P-Ta",
"density": 11.588288018024391,
"density_atomic": 0.07818707488897847,
"volume": 153.47805269655333,
"volume_molar": 7.702220307577848,
"formula_full": "Ta4 Fe4 P4",
"formula_reduced": "TaFeP",
"formula_anonymous": "ABC",
"energy_above_hull": 3.615836733333334,
"spacegroup": 62
},
{
"id": "jvasp-90164",
"created_at": "2022-09-04T14:35:58.880171Z",
"updated_at": "2022-09-04T14:35:58.880199Z",
"structure_string": "Si1 N2 F6\n1.0\n0.188218 0.108668 -4.858741\n-2.699459 -4.534718 0.210681\n-2.577453 4.464277 0.000000\nSi N F\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Si\n0.689103 0.465659 0.732830 N\n0.310897 0.534340 0.267170 N\n0.259015 0.790427 0.895214 F\n0.172366 0.230266 0.884750 F\n0.172366 0.230267 0.345517 F\n0.740985 0.209572 0.104786 F\n0.827634 0.769733 0.115250 F\n0.827634 0.769733 0.654483 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Si",
"N",
"F"
],
"chemical_system": "F-N-Si",
"density": 2.453730016967457,
"density_atomic": 0.07818854741403163,
"volume": 115.1063716830845,
"volume_molar": 7.702075251649033,
"formula_full": "Si1 N2 F6",
"formula_reduced": "Si(NF3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.5697674216666664,
"spacegroup": 12
},
{
"id": "jvasp-85844",
"created_at": "2022-09-04T14:36:06.407163Z",
"updated_at": "2022-09-04T14:36:06.407198Z",
"structure_string": "Sm2 Fe17\n1.0\n6.240972 0.033997 0.794405\n0.703953 6.201237 0.794405\n0.037866 0.033997 6.291214\nSm Fe\n2 17\ndirect\n0.344551 0.344552 0.344552 Sm\n0.655448 0.655450 0.655449 Sm\n0.847528 0.335686 0.335686 Fe\n0.152472 0.664315 0.664315 Fe\n0.664314 0.664315 0.152473 Fe\n0.664314 0.152472 0.664315 Fe\n0.290726 0.000000 0.709274 Fe\n-0.000000 0.709275 0.290726 Fe\n0.709274 0.290726 0.000001 Fe\n0.335686 0.335686 0.847528 Fe\n0.290725 0.709275 0.000001 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.909184 0.909185 0.909185 Fe\n0.090816 0.090816 0.090816 Fe\n0.335685 0.847529 0.335686 Fe\n0.000000 0.290726 0.709274 Fe\n0.709274 0.000000 0.290726 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Sm",
"Fe"
],
"chemical_system": "Fe-Sm",
"density": 8.542611966232949,
"density_atomic": 0.07819079686528314,
"volume": 242.9953493470027,
"volume_molar": 7.701853672594866,
"formula_full": "Sm2 Fe17",
"formula_reduced": "Sm2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.07868375,
"spacegroup": 166
},
{
"id": "jvasp-86343",
"created_at": "2022-09-04T14:35:51.062641Z",
"updated_at": "2022-09-04T14:35:51.062656Z",
"structure_string": "Sm2 Fe17\n1.0\n6.240972 0.033997 0.794405\n0.703953 6.201237 0.794405\n0.037866 0.033997 6.291214\nSm Fe\n2 17\ndirect\n0.344551 0.344552 0.344552 Sm\n0.655448 0.655450 0.655449 Sm\n0.847528 0.335686 0.335686 Fe\n0.152472 0.664315 0.664315 Fe\n0.664314 0.664315 0.152473 Fe\n0.664314 0.152472 0.664315 Fe\n0.290726 0.000000 0.709274 Fe\n-0.000000 0.709275 0.290726 Fe\n0.709274 0.290726 0.000001 Fe\n0.335686 0.335686 0.847528 Fe\n0.290725 0.709275 0.000001 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.909184 0.909185 0.909185 Fe\n0.090816 0.090816 0.090816 Fe\n0.335685 0.847529 0.335686 Fe\n0.000000 0.290726 0.709274 Fe\n0.709274 0.000000 0.290726 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Sm",
"Fe"
],
"chemical_system": "Fe-Sm",
"density": 8.542611966232949,
"density_atomic": 0.07819079686528314,
"volume": 242.9953493470027,
"volume_molar": 7.701853672594866,
"formula_full": "Sm2 Fe17",
"formula_reduced": "Sm2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.07868375,
"spacegroup": 166
},
{
"id": "jvasp-74520",
"created_at": "2022-09-04T14:35:48.668742Z",
"updated_at": "2022-09-04T14:35:48.668770Z",
"structure_string": "Be2 Cr1 Sb1\n1.0\n-1.797771 1.797771 3.956962\n1.797771 -1.797771 3.956962\n1.797771 1.797771 -3.956962\nBe Cr Sb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.500000 Be\n0.500000 0.500000 0.000000 Cr\n0.749999 0.250000 0.500000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Sb"
],
"chemical_system": "Be-Cr-Sb",
"density": 6.225336773736951,
"density_atomic": 0.07819327070311789,
"volume": 51.155297176237745,
"volume_molar": 7.701610005373356,
"formula_full": "Be2 Cr1 Sb1",
"formula_reduced": "Be2CrSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6006264250000006,
"spacegroup": 119
},
{
"id": "jvasp-102985",
"created_at": "2022-09-04T14:37:00.007022Z",
"updated_at": "2022-09-04T14:37:00.007044Z",
"structure_string": "Sr1 Mg1 O3\n1.0\n3.998820 0.000000 0.000000\n-0.000000 3.998820 0.000000\n-0.000000 -0.000000 3.998820\nSr Mg O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"O"
],
"chemical_system": "Mg-O-Sr",
"density": 4.153029366463877,
"density_atomic": 0.07819418143803418,
"volume": 63.94337670715696,
"volume_molar": 7.70152030400409,
"formula_full": "Sr1 Mg1 O3",
"formula_reduced": "SrMgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.9183753999999996,
"spacegroup": 221
}
]
}