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=-nsites&page=1259",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=1257",
"results": [
{
"id": "jvasp-28638",
"created_at": "2022-09-04T14:35:41.441678Z",
"updated_at": "2022-09-04T14:35:41.441698Z",
"structure_string": "Te4 Mo3 W1 S4\n1.0\n3.371127 0.000004 -0.000008\n-1.685561 2.919488 -0.000034\n-0.000093 -0.000402 35.688851\nTe Mo W S\n4 3 1 4\ndirect\n0.333358 0.666710 0.335384 Te\n0.333357 0.666707 0.709591 Te\n0.333330 0.666664 0.228812 Te\n0.333347 0.666690 0.603635 Te\n0.333317 0.666634 0.094813 Mo\n0.333324 0.666647 0.469348 Mo\n0.666685 0.333365 0.656686 Mo\n0.666677 0.333353 0.282102 W\n0.666644 0.333289 0.052508 S\n0.666644 0.333295 0.427024 S\n0.666657 0.333312 0.137177 S\n0.666672 0.333332 0.511669 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 5.249072704888871,
"density_atomic": 0.03416383172336481,
"volume": 351.2486566837039,
"volume_molar": 17.627240435918164,
"formula_full": "Te4 Mo3 W1 S4",
"formula_reduced": "Te4Mo3WS4",
"formula_anonymous": "AB3C4D4",
"energy_above_hull": 3.732984063888889,
"spacegroup": 156
},
{
"id": "jvasp-29181",
"created_at": "2022-09-04T14:35:43.214295Z",
"updated_at": "2022-09-04T14:35:43.214325Z",
"structure_string": "Te4 Mo1 W3 Se2 S2\n1.0\n3.418333 0.000000 0.000000\n-1.709167 2.960378 -0.000226\n0.000000 -0.003085 40.219834\nTe Mo W Se S\n4 1 3 2 2\ndirect\n0.333425 0.666854 0.705971 Te\n0.666595 0.333192 0.421006 Te\n0.666635 0.333271 0.514531 Te\n0.333363 0.666731 0.612852 Te\n0.333326 0.666654 0.093915 Mo\n0.333265 0.666533 0.467812 W\n0.666661 0.333322 0.281621 W\n0.666734 0.333469 0.659692 W\n0.666649 0.333300 0.053387 Se\n0.666697 0.333395 0.134643 Se\n0.333340 0.666684 0.319028 S\n0.333302 0.666606 0.244288 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.629865926754004,
"density_atomic": 0.029483527258348942,
"volume": 407.0069328832398,
"volume_molar": 20.425442000989527,
"formula_full": "Te4 Mo1 W3 Se2 S2",
"formula_reduced": "Te4MoW3(SeS)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.039876975,
"spacegroup": 156
},
{
"id": "jvasp-87070",
"created_at": "2022-09-04T14:35:42.667878Z",
"updated_at": "2022-09-04T14:35:42.667906Z",
"structure_string": "Ca4 Sb4 Pt4\n1.0\n4.628154 -0.000000 0.000000\n0.000000 7.359112 0.000000\n0.000000 0.000000 7.978440\nCa Sb Pt\n4 4 4\ndirect\n0.749999 0.992818 0.301568 Ca\n0.250000 0.007182 0.698432 Ca\n0.749999 0.492818 0.198432 Ca\n0.250000 0.507182 0.801568 Ca\n0.749999 0.312066 0.590560 Sb\n0.250000 0.187934 0.090560 Sb\n0.250000 0.687934 0.409440 Sb\n0.749999 0.812066 0.909440 Sb\n0.250000 0.800090 0.084958 Pt\n0.250000 0.300090 0.415042 Pt\n0.749999 0.699910 0.584958 Pt\n0.749999 0.199910 0.915042 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"Pt"
],
"chemical_system": "Ca-Pt-Sb",
"density": 8.724312415985942,
"density_atomic": 0.044160100039873744,
"volume": 271.7385148395218,
"volume_molar": 13.637063218974578,
"formula_full": "Ca4 Sb4 Pt4",
"formula_reduced": "CaSbPt",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7861326400000003,
"spacegroup": 62
},
{
"id": "jvasp-85573",
"created_at": "2022-09-04T14:35:46.285060Z",
"updated_at": "2022-09-04T14:35:46.285077Z",
"structure_string": "V4 O8\n1.0\n4.807336 1.016650 0.376056\n1.560643 4.690353 -0.164651\n1.390302 -0.562025 7.336824\nV O\n4 8\ndirect\n0.137911 0.724036 0.000699 V\n0.862089 0.275964 -0.000697 V\n0.319319 0.082985 0.249521 V\n0.680681 0.917013 0.750480 V\n0.826153 0.839380 0.525589 O\n0.173847 0.160619 0.474411 O\n0.285023 0.940470 0.830057 O\n0.714978 0.059529 0.169944 O\n0.587634 0.310502 0.847098 O\n0.412367 0.689496 0.152903 O\n0.947966 0.589797 0.848918 O\n0.052034 0.410202 0.151082 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"V",
"O"
],
"chemical_system": "O-V",
"density": 3.6645974114949205,
"density_atomic": 0.07982387855498664,
"volume": 150.33095631570703,
"volume_molar": 7.544284829321656,
"formula_full": "V4 O8",
"formula_reduced": "VO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.9254870666666672,
"spacegroup": 2
},
{
"id": "jvasp-28709",
"created_at": "2022-09-04T14:35:42.662781Z",
"updated_at": "2022-09-04T14:35:42.662801Z",
"structure_string": "Te4 Mo4 S4\n1.0\n3.369107 -0.000002 0.000007\n-1.684556 2.917735 -0.000040\n0.000076 -0.000429 35.701786\nTe Mo S\n4 4 4\ndirect\n0.333337 0.666680 0.335140 Te\n0.333361 0.666727 0.709632 Te\n0.333351 0.666698 0.229040 Te\n0.333339 0.666670 0.603665 Te\n0.333314 0.666630 0.094751 Mo\n0.333324 0.666646 0.469383 Mo\n0.666679 0.333355 0.282094 Mo\n0.666685 0.333365 0.656722 Mo\n0.666637 0.333269 0.052444 S\n0.666653 0.333300 0.427055 S\n0.666660 0.333326 0.137118 S\n0.666663 0.333327 0.511705 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 4.8375781183461415,
"density_atomic": 0.0341924958935592,
"volume": 350.95419876208643,
"volume_molar": 17.612463210485853,
"formula_full": "Te4 Mo4 S4",
"formula_reduced": "TeMoS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.436967888888889,
"spacegroup": 156
},
{
"id": "jvasp-86771",
"created_at": "2022-09-04T14:35:46.166692Z",
"updated_at": "2022-09-04T14:35:46.166719Z",
"structure_string": "Ag8 Se4\n1.0\n4.598021 0.000000 0.000000\n0.000000 7.291458 0.000000\n0.000000 0.000000 7.716922\nAg Se\n8 4\ndirect\n0.005134 0.099535 0.249974 Ag\n0.994866 0.099535 0.750025 Ag\n0.500000 0.610927 0.000000 Ag\n0.494866 0.900465 0.249974 Ag\n0.000000 0.389073 0.000000 Ag\n0.000000 0.389042 0.500000 Ag\n0.505134 0.900465 0.750025 Ag\n0.500000 0.610958 0.500000 Ag\n0.520956 0.293547 0.250002 Se\n0.479044 0.293547 0.749998 Se\n0.020956 0.706453 0.749998 Se\n0.979044 0.706453 0.250002 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ag",
"Se"
],
"chemical_system": "Ag-Se",
"density": 7.565793435181798,
"density_atomic": 0.04638224936934494,
"volume": 258.7196645950308,
"volume_molar": 12.983718646427198,
"formula_full": "Ag8 Se4",
"formula_reduced": "Ag2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2749892955555557,
"spacegroup": 53
},
{
"id": "jvasp-28959",
"created_at": "2022-09-04T14:35:42.660132Z",
"updated_at": "2022-09-04T14:35:42.660158Z",
"structure_string": "Te4 Mo2 W2 Se2 S2\n1.0\n3.404395 -0.000140 0.000163\n-1.702318 2.948570 0.001017\n0.001682 0.013335 35.143388\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.333174 0.666392 0.728524 Te\n0.666769 0.333365 0.413563 Te\n0.666413 0.332613 0.520327 Te\n0.333804 0.667627 0.621293 Te\n0.333202 0.666270 0.466975 Mo\n0.666567 0.333041 0.270455 Mo\n0.333310 0.666916 0.090581 W\n0.666917 0.333759 0.674970 W\n0.333009 0.665973 0.317367 Se\n0.333436 0.666791 0.223552 Se\n0.666958 0.334139 0.047671 S\n0.666448 0.333121 0.133471 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 6.0817747637456145,
"density_atomic": 0.03401704665804328,
"volume": 352.76431021864204,
"volume_molar": 17.70330276034141,
"formula_full": "Te4 Mo2 W2 Se2 S2",
"formula_reduced": "Te2MoWSeS",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.462604133333333,
"spacegroup": 156
},
{
"id": "jvasp-85837",
"created_at": "2022-09-04T14:35:46.651826Z",
"updated_at": "2022-09-04T14:35:46.651854Z",
"structure_string": "Si4 Ni8\n1.0\n3.733554 -0.000000 0.000000\n0.000000 5.084831 0.000000\n0.000000 0.000000 7.074520\nSi Ni\n4 8\ndirect\n0.250000 0.782483 0.115162 Si\n0.749999 0.217517 0.884838 Si\n0.250000 0.282483 0.384838 Si\n0.749999 0.717516 0.615162 Si\n0.250000 0.960440 0.798882 Ni\n0.749999 0.039560 0.201118 Ni\n0.250000 0.460440 0.701118 Ni\n0.749999 0.539560 0.298882 Ni\n0.250000 0.832515 0.439439 Ni\n0.749999 0.167485 0.560561 Ni\n0.250000 0.332515 0.060561 Ni\n0.749999 0.667484 0.939439 Ni\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"Ni"
],
"chemical_system": "Ni-Si",
"density": 7.194381358419409,
"density_atomic": 0.08934809699817921,
"volume": 134.30616211383375,
"volume_molar": 6.740088443207383,
"formula_full": "Si4 Ni8",
"formula_reduced": "SiNi2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.381861133333333,
"spacegroup": 62
},
{
"id": "jvasp-52900",
"created_at": "2022-09-04T14:35:42.145187Z",
"updated_at": "2022-09-04T14:35:42.145220Z",
"structure_string": "H8 O4\n1.0\n2.179855 3.807327 0.000000\n-2.179855 3.807327 0.000000\n0.000000 0.000000 7.085356\nH O\n8 4\ndirect\n0.340021 0.340021 0.701212 H\n0.659980 0.659980 0.201212 H\n0.470574 0.470574 0.518436 H\n0.529426 0.529426 0.018435 H\n0.927501 0.555107 0.481789 H\n0.555107 0.927501 0.481789 H\n0.072500 0.444894 0.981789 H\n0.444894 0.072500 0.981789 H\n0.343769 0.343769 0.559045 O\n0.656232 0.656232 0.059045 O\n0.675617 0.675617 0.435731 O\n0.324384 0.324384 0.935731 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"H",
"O"
],
"chemical_system": "H-O",
"density": 1.017444313393518,
"density_atomic": 0.10203326630784663,
"volume": 117.6087018893873,
"volume_molar": 5.90213464482307,
"formula_full": "H8 O4",
"formula_reduced": "H2O",
"formula_anonymous": "AB2",
"energy_above_hull": 1.9034945,
"spacegroup": 36
},
{
"id": "jvasp-42577",
"created_at": "2022-09-04T14:35:41.669857Z",
"updated_at": "2022-09-04T14:35:41.669883Z",
"structure_string": "Li4 Fe2 O6\n1.0\n-2.851451 0.000016 -0.000318\n-0.000130 -5.784207 0.003448\n1.425176 1.508548 5.941805\nLi Fe O\n4 2 6\ndirect\n0.673627 0.826553 0.347002 Li\n0.993021 0.506758 0.986317 Li\n0.333326 0.166661 0.666659 Li\n0.333329 0.666666 0.666667 Li\n0.672807 0.340021 0.345622 Fe\n0.993852 0.993305 0.987704 Fe\n0.507241 0.229410 0.014503 O\n0.821239 0.408704 0.642504 O\n0.845423 0.924622 0.690825 O\n0.504035 0.781726 0.008026 O\n0.159422 0.103920 0.318823 O\n0.162628 0.551603 0.325302 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 3.9890206774446493,
"density_atomic": 0.12243314441983812,
"volume": 98.01267505513493,
"volume_molar": 4.918717712051361,
"formula_full": "Li4 Fe2 O6",
"formula_reduced": "Li2FeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.9123559999999995,
"spacegroup": 12
},
{
"id": "jvasp-99102",
"created_at": "2022-09-04T14:35:42.811067Z",
"updated_at": "2022-09-04T14:35:42.811092Z",
"structure_string": "Al2 P2 S8\n1.0\n6.428969 0.000000 0.000000\n0.000000 6.428969 0.000000\n0.000000 0.000000 7.694969\nAl P S\n2 2 8\ndirect\n0.000000 0.000000 0.584671 Al\n0.000000 0.000000 0.084671 Al\n0.000000 0.500000 0.084665 P\n0.500000 0.000000 0.584665 P\n0.732637 0.238771 0.584666 S\n0.761229 0.267364 0.084666 S\n0.732637 0.761229 0.584666 S\n0.238771 0.732637 0.084666 S\n0.267364 0.761229 0.584666 S\n0.238771 0.267364 0.084666 S\n0.761229 0.732637 0.084666 S\n0.267364 0.238771 0.584666 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"P",
"S"
],
"chemical_system": "Al-P-S",
"density": 1.9444864346832127,
"density_atomic": 0.037730425959271265,
"volume": 318.04570700987045,
"volume_molar": 15.960966797726323,
"formula_full": "Al2 P2 S8",
"formula_reduced": "AlPS4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2517713833333337,
"spacegroup": 131
},
{
"id": "jvasp-48815",
"created_at": "2022-09-04T14:35:41.206204Z",
"updated_at": "2022-09-04T14:35:41.206232Z",
"structure_string": "Fe4 O5 F3\n1.0\n-4.718415 0.309330 0.000000\n-0.311427 4.702818 -2.851408\n0.311427 -4.702818 -2.851408\nFe O F\n4 5 3\ndirect\n0.534855 0.012805 0.487195 Fe\n0.497016 0.502849 -0.002848 Fe\n0.991132 0.476968 0.485913 Fe\n0.991132 0.014087 0.023033 Fe\n0.809001 0.154019 0.345981 O\n0.698723 0.152505 0.850549 O\n0.698724 0.649452 0.347495 O\n0.303446 0.856222 0.156307 O\n0.303446 0.343694 0.643779 O\n0.795617 0.646183 0.853818 F\n0.209361 0.358026 0.141974 F\n0.167543 0.833193 0.666809 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.749482025516052,
"density_atomic": 0.09524169248137883,
"volume": 125.99524102688724,
"volume_molar": 6.3230089712836826,
"formula_full": "Fe4 O5 F3",
"formula_reduced": "Fe4O5F3",
"formula_anonymous": "A3B4C5",
"energy_above_hull": 2.442028362291667,
"spacegroup": 8
}
]
}