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=spacegroup&page=301",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=299",
"results": [
{
"id": "jvasp-33907",
"created_at": "2022-09-04T14:38:35.255250Z",
"updated_at": "2022-09-04T14:38:35.255268Z",
"structure_string": "Te7 Mo6 S5\n1.0\n-1.870696 -2.852346 0.000031\n6.398194 -6.236190 -0.089970\n-1.632836 3.110797 14.084627\nTe Mo S\n7 6 5\ndirect\n0.472203 0.164438 0.108849 Te\n0.106459 0.401408 0.614332 Te\n0.520269 0.843640 0.884193 Te\n0.225756 0.928854 0.380342 Te\n0.153502 0.809539 0.116528 Te\n0.431759 0.760927 0.624460 Te\n0.905856 0.578672 0.390352 Te\n0.306212 0.642725 0.255132 Mo\n0.703524 0.345871 0.752923 Mo\n0.628693 0.987163 0.244550 Mo\n0.037729 0.676243 0.751691 Mo\n0.966567 0.315431 0.248567 Mo\n0.360552 0.036738 0.757857 Mo\n0.823892 0.501741 0.149489 S\n0.554486 0.241269 0.350235 S\n0.843434 0.179309 0.866191 S\n0.180821 0.494641 0.856288 S\n0.778307 0.091380 0.648023 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.434864034715756,
"density_atomic": 0.04281517378745602,
"volume": 420.41170005185484,
"volume_molar": 14.065435749239828,
"formula_full": "Te7 Mo6 S5",
"formula_reduced": "Te7Mo6S5",
"formula_anonymous": "A5B6C7",
"energy_above_hull": 3.5881688759259256,
"spacegroup": 8
},
{
"id": "jvasp-44406",
"created_at": "2022-09-04T14:38:35.315438Z",
"updated_at": "2022-09-04T14:38:35.315467Z",
"structure_string": "Li4 V3 Cr3 W2 O16\n1.0\n5.861128 -0.001352 0.000286\n-2.929384 5.073737 0.017154\n-0.000131 0.017556 9.589778\nLi V Cr W O\n4 3 3 2 16\ndirect\n0.331564 0.663152 0.096264 Li\n0.001754 0.003533 0.007327 Li\n0.993778 0.987590 0.506856 Li\n0.664097 0.328212 0.599927 Li\n0.174387 0.348788 0.782016 V\n0.344310 0.165735 0.285780 V\n0.821410 0.165740 0.285778 V\n0.661863 0.832220 0.785667 Cr\n0.830869 0.661751 0.286609 Cr\n0.170339 0.832223 0.785670 Cr\n0.327321 0.654671 0.514726 W\n0.667290 0.334608 0.010213 W\n0.832324 0.664675 0.906909 O\n0.339874 0.173164 0.905550 O\n0.667099 0.334226 0.397688 O\n0.960253 0.483167 0.156595 O\n0.522894 0.483172 0.156601 O\n0.165725 0.331480 0.406088 O\n0.493868 0.525549 0.654969 O\n0.479873 0.959754 0.660006 O\n0.655737 0.828275 0.405271 O\n0.001761 0.003529 0.193027 O\n0.001158 0.002320 0.690346 O\n0.336148 0.672329 0.895794 O\n0.516591 0.033195 0.150682 O\n0.172515 0.828267 0.405273 O\n0.031657 0.525543 0.654978 O\n0.833266 0.173157 0.905550 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"Cr",
"W",
"O"
],
"chemical_system": "Cr-Li-O-V-W",
"density": 5.592100788481177,
"density_atomic": 0.09819760025453837,
"volume": 285.1393509354719,
"volume_molar": 6.1326760983873205,
"formula_full": "Li4 V3 Cr3 W2 O16",
"formula_reduced": "Li4V3Cr3(WO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.7948693142857137,
"spacegroup": 8
},
{
"id": "jvasp-119136",
"created_at": "2022-09-04T14:38:35.359496Z",
"updated_at": "2022-09-04T14:38:35.359528Z",
"structure_string": "Ti2 Al2 Cr1 Cu1 S8\n1.0\n6.061794 0.000416 3.492797\n-4.058256 5.920420 0.000000\n-0.000000 0.000000 6.985593\nTi Al Cr Cu S\n2 2 1 1 8\ndirect\n0.024464 0.006740 0.464397 Ti\n0.024464 0.006740 0.011138 Ti\n0.237243 0.608703 0.631378 Al\n0.494979 0.497241 0.002511 Al\n0.474701 0.002863 0.012650 Cr\n0.749703 0.376445 0.375149 Cu\n0.006648 0.754093 0.246676 S\n0.013373 0.249507 0.243314 S\n0.498071 0.252516 0.768812 S\n0.498071 0.252516 0.233116 S\n0.973972 0.221735 0.763014 S\n0.987270 0.756085 0.756365 S\n0.508518 0.757410 0.229417 S\n0.508518 0.757410 0.762065 S\n",
"nsites": 14,
"nelements": 5,
"elements": [
"Ti",
"Al",
"Cr",
"Cu",
"S"
],
"chemical_system": "Al-Cr-Cu-S-Ti",
"density": 3.455745851706123,
"density_atomic": 0.05584067212020487,
"volume": 250.71331465823047,
"volume_molar": 10.784506223414537,
"formula_full": "Ti2 Al2 Cr1 Cu1 S8",
"formula_reduced": "Ti2Al2CrCuS8",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.613890008333333,
"spacegroup": 8
},
{
"id": "jvasp-34043",
"created_at": "2022-09-04T14:38:36.384724Z",
"updated_at": "2022-09-04T14:38:36.384748Z",
"structure_string": "Te8 Mo6 S4\n1.0\n-1.542893 3.078430 0.000048\n7.149645 5.509461 0.022489\n1.834247 2.845555 -14.052476\nTe Mo S\n8 6 4\ndirect\n0.299759 0.009378 0.391165 Te\n0.353661 0.673579 0.619035 Te\n0.265644 0.589517 0.879115 Te\n0.980415 0.657481 0.381757 Te\n0.738352 0.412307 0.111090 Te\n0.029618 0.323831 0.616861 Te\n0.940685 0.237393 0.881152 Te\n0.058321 0.762878 0.120579 Te\n0.543288 0.164352 0.748994 Mo\n0.796279 0.155255 0.252252 Mo\n0.195927 0.858935 0.749126 Mo\n0.458147 0.828754 0.255023 Mo\n0.869869 0.511018 0.749193 Mo\n0.136315 0.482151 0.245305 Mo\n0.385682 0.077924 0.150789 S\n0.651927 0.346096 0.350145 S\n0.611303 0.919311 0.857979 S\n0.684815 0.989845 0.640441 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.676299457188542,
"density_atomic": 0.041960982885018476,
"volume": 428.9699325996156,
"volume_molar": 14.351762866236655,
"formula_full": "Te8 Mo6 S4",
"formula_reduced": "Te4Mo3S2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 3.288398751851852,
"spacegroup": 8
},
{
"id": "jvasp-33995",
"created_at": "2022-09-04T14:38:35.712818Z",
"updated_at": "2022-09-04T14:38:35.712838Z",
"structure_string": "Te7 Mo6 S5\n1.0\n-0.343924 -5.877918 -0.046859\n0.008568 0.106942 13.683745\n-4.925664 3.237152 0.024298\nTe Mo S\n7 6 5\ndirect\n0.680435 0.875538 0.997315 Te\n-0.004919 0.387317 0.332671 Te\n0.985797 0.116248 0.335691 Te\n0.349790 0.875538 0.336024 Te\n0.329071 0.387317 0.000652 Te\n0.316765 0.116247 0.997629 Te\n0.661016 0.395933 0.666660 Te\n0.335516 0.251765 0.345212 Mo\n0.686809 0.736267 0.666669 Mo\n0.656962 0.251764 0.988108 Mo\n0.009383 0.737475 0.343767 Mo\n0.977905 0.252682 0.666663 Mo\n0.332288 0.737475 0.989574 Mo\n0.338184 0.631653 0.332560 S\n0.672295 0.631653 0.000781 S\n0.653316 0.143906 0.666662 S\n0.006558 0.623708 0.666672 S\n0.012827 0.847513 0.666671 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.575985764266929,
"density_atomic": 0.04375414488977035,
"volume": 411.3895962393353,
"volume_molar": 13.76358919862691,
"formula_full": "Te7 Mo6 S5",
"formula_reduced": "Te7Mo6S5",
"formula_anonymous": "A5B6C7",
"energy_above_hull": 3.5890427648148147,
"spacegroup": 8
},
{
"id": "jvasp-119160",
"created_at": "2022-09-04T14:38:35.907152Z",
"updated_at": "2022-09-04T14:38:35.907162Z",
"structure_string": "Nb5 V3 S20\n1.0\n8.537149 -0.043933 4.116578\n5.938166 6.133762 4.116578\n-0.052097 -0.021918 10.138527\nNb V S\n5 3 20\ndirect\n0.330459 0.834455 0.862046 Nb\n0.834456 0.330459 0.862046 Nb\n0.166051 0.166051 0.140498 Nb\n0.666308 0.666308 0.141474 Nb\n0.801642 0.801642 0.592115 Nb\n0.304027 0.304027 0.592242 V\n0.694092 0.204089 0.403648 V\n0.204090 0.694092 0.403648 V\n0.979679 0.478210 0.253212 S\n0.310837 0.809767 0.137832 S\n0.809767 0.310837 0.137832 S\n0.959717 0.442069 0.587760 S\n0.686855 0.686854 0.869173 S\n0.442070 0.959717 0.587760 S\n0.478211 0.979679 0.253212 S\n0.189408 0.189408 0.863277 S\n0.521759 0.521759 0.747600 S\n0.616561 0.133099 0.662080 S\n0.883885 0.883884 0.326421 S\n0.378645 0.378645 0.336452 S\n0.046146 0.046146 0.411007 S\n0.133100 0.616561 0.662080 S\n0.036402 0.536494 0.022545 S\n0.536494 0.036402 0.022545 S\n0.462360 0.462360 0.978175 S\n0.961634 0.961633 0.980790 S\n0.019001 0.019000 0.749946 S\n0.546350 0.546350 0.412595 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Nb",
"V",
"S"
],
"chemical_system": "Nb-S-V",
"density": 3.905853210391302,
"density_atomic": 0.052326015202566856,
"volume": 535.1066747889195,
"volume_molar": 11.508884704265771,
"formula_full": "Nb5 V3 S20",
"formula_reduced": "Nb5V3S20",
"formula_anonymous": "A3B5C20",
"energy_above_hull": 3.561199985714286,
"spacegroup": 8
},
{
"id": "jvasp-119161",
"created_at": "2022-09-04T14:38:35.955969Z",
"updated_at": "2022-09-04T14:38:35.955997Z",
"structure_string": "Na6 Cd7 S10\n1.0\n12.796324 0.013427 4.089141\n12.112430 4.127361 4.089141\n0.013402 0.002228 10.426370\nNa Cd S\n6 7 10\ndirect\n0.707389 0.707390 0.378045 Na\n0.300507 0.300508 0.583186 Na\n0.119687 0.119688 0.249302 Na\n0.892649 0.892650 0.759240 Na\n0.989534 0.989535 0.184374 Na\n0.002843 0.002843 0.818470 Na\n0.350398 0.350398 0.047293 Cd\n0.751019 0.751021 0.900616 Cd\n0.159851 0.159852 0.711904 Cd\n0.608654 0.608655 0.030792 Cd\n0.445629 0.445630 0.476361 Cd\n0.563071 0.563072 0.520892 Cd\n0.846085 0.846087 0.298199 Cd\n0.909766 0.909767 0.050507 S\n0.535751 0.535752 0.290759 S\n0.471675 0.471676 0.693953 S\n0.886959 0.886960 0.486807 S\n0.122572 0.122573 0.510092 S\n0.683676 0.683677 0.126940 S\n0.314476 0.314477 0.848729 S\n0.287866 0.287866 0.303330 S\n0.720098 0.720100 0.682136 S\n0.081029 0.081030 0.931075 S\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Na",
"Cd",
"S"
],
"chemical_system": "Cd-Na-S",
"density": 3.768883703770804,
"density_atomic": 0.041914060217188534,
"volume": 548.7418751802988,
"volume_molar": 14.367829622791781,
"formula_full": "Na6 Cd7 S10",
"formula_reduced": "Na6Cd7S10",
"formula_anonymous": "A6B7C10",
"energy_above_hull": 0.0379696630434781,
"spacegroup": 8
},
{
"id": "jvasp-31720",
"created_at": "2022-09-04T14:38:36.066332Z",
"updated_at": "2022-09-04T14:38:36.066360Z",
"structure_string": "Nb1 W5 Se12\n1.0\n-1.845322 -2.805195 -0.000066\n6.370002 -6.199814 -0.000130\n-1.508232 3.002023 13.102956\nNb W Se\n1 5 12\ndirect\n0.692843 0.364487 0.750001 Nb\n0.972140 0.305515 0.250000 W\n0.363340 0.023522 0.749999 W\n0.305437 0.638869 0.249942 W\n0.027134 0.695939 0.750001 W\n0.638791 0.972279 0.250057 W\n0.818515 0.485181 0.122452 Se\n0.903492 0.570211 0.377365 Se\n0.515535 0.847077 0.877891 Se\n0.765251 0.092114 0.622450 Se\n0.485181 0.151926 0.122532 Se\n0.570205 0.236952 0.377535 Se\n0.850314 0.177158 0.877547 Se\n0.236884 0.903571 0.377503 Se\n0.151859 0.818659 0.122613 Se\n0.430245 0.761800 0.622111 Se\n0.092863 0.433835 0.619420 Se\n0.179951 0.520900 0.880581 Se\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Nb",
"W",
"Se"
],
"chemical_system": "Nb-Se-W",
"density": 8.47311556572411,
"density_atomic": 0.04686981726297651,
"volume": 384.0424616764741,
"volume_molar": 12.848654233514626,
"formula_full": "Nb1 W5 Se12",
"formula_reduced": "NbW5Se12",
"formula_anonymous": "AB5C12",
"energy_above_hull": 4.279730544444445,
"spacegroup": 8
},
{
"id": "jvasp-117626",
"created_at": "2022-09-04T14:38:36.268600Z",
"updated_at": "2022-09-04T14:38:36.268626Z",
"structure_string": "Ba1 Se3\n1.0\n8.468024 0.238100 -1.257789\n-5.177769 -4.399643 0.879580\n2.570880 2.622245 -3.851745\nBa Se\n1 3\ndirect\n0.688427 0.076908 0.456243 Ba\n0.185925 0.073817 -0.029375 Se\n0.673351 0.561488 0.458440 Se\n0.120269 0.150823 0.666846 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 5.067941879584437,
"density_atomic": 0.03262350450195048,
"volume": 122.61098435212102,
"volume_molar": 18.459515162265756,
"formula_full": "Ba1 Se3",
"formula_reduced": "BaSe3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0581041833333331,
"spacegroup": 8
},
{
"id": "jvasp-111025",
"created_at": "2022-09-04T14:38:36.318741Z",
"updated_at": "2022-09-04T14:38:36.318763Z",
"structure_string": "Mn1 Zn4 Se5\n1.0\n6.213289 0.001160 3.313219\n4.883193 3.841794 3.313219\n-0.007371 -0.002553 9.964842\nMn Zn Se\n1 4 5\ndirect\n0.000976 0.000977 0.998997 Mn\n0.600690 0.600689 0.596355 Zn\n0.199040 0.199039 0.201314 Zn\n0.801672 0.801671 0.799068 Zn\n0.398121 0.398120 0.403375 Zn\n0.798869 0.798868 0.551782 Se\n0.397247 0.397246 0.154989 Se\n0.001666 0.001667 0.745941 Se\n0.598775 0.598774 0.348908 Se\n0.202946 0.202947 0.949270 Se\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"Se"
],
"chemical_system": "Mn-Se-Zn",
"density": 4.965149641294886,
"density_atomic": 0.04203250070035153,
"volume": 237.91113622502996,
"volume_molar": 14.327343507186656,
"formula_full": "Mn1 Zn4 Se5",
"formula_reduced": "MnZn4Se5",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.519897567471264,
"spacegroup": 8
},
{
"id": "jvasp-34039",
"created_at": "2022-09-04T14:38:36.387056Z",
"updated_at": "2022-09-04T14:38:36.387084Z",
"structure_string": "Te6 Mo6 S6\n1.0\n-1.514642 3.020020 0.000015\n7.017739 5.409450 0.012090\n1.815394 2.800368 -14.043286\nTe Mo S\n6 6 6\ndirect\n0.345442 0.691021 0.618117 Te\n0.980761 0.650319 0.388135 Te\n0.739637 0.407895 0.112806 Te\n0.022140 0.339593 0.616156 Te\n0.932305 0.251527 0.883893 Te\n0.256790 0.604109 0.882336 Te\n0.534627 0.180708 0.750066 Mo\n0.809488 0.134262 0.246739 Mo\n0.188127 0.873542 0.750227 Mo\n0.467196 0.812940 0.252642 Mo\n0.861819 0.526230 0.750157 Mo\n0.138607 0.472632 0.250131 Mo\n0.058657 0.734149 0.148510 S\n0.602842 0.933891 0.860448 S\n0.676959 0.006194 0.639909 S\n0.400484 0.059636 0.139372 S\n0.663210 0.321138 0.352418 S\n0.320911 0.000212 0.357943 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.169081096897566,
"density_atomic": 0.04360369484737501,
"volume": 412.8090535218398,
"volume_molar": 13.811079040616073,
"formula_full": "Te6 Mo6 S6",
"formula_reduced": "TeMoS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.415507888888889,
"spacegroup": 8
},
{
"id": "jvasp-33911",
"created_at": "2022-09-04T14:38:36.590395Z",
"updated_at": "2022-09-04T14:38:36.590415Z",
"structure_string": "Te5 Mo4 S3\n1.0\n1.898054 3.066508 13.991025\n-1.552654 2.830784 -13.901592\n-1.865924 -2.630575 13.902432\nTe Mo S\n5 4 3\ndirect\n0.678601 0.370425 0.308192 Te\n0.215461 0.652658 0.562802 Te\n0.325535 0.629997 0.695518 Te\n0.788414 0.349123 0.439286 Te\n0.711608 0.652323 0.059292 Te\n0.447401 0.318380 0.129012 Mo\n0.545722 0.671919 0.873803 Mo\n0.928697 0.300420 0.628273 Mo\n0.082545 0.708226 0.374320 Mo\n0.181345 0.361923 0.819438 S\n0.817732 0.636866 0.180855 S\n0.276940 0.347737 0.929200 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.5814082185044835,
"density_atomic": 0.04254285731130669,
"volume": 282.0685012337133,
"volume_molar": 14.155468486597123,
"formula_full": "Te5 Mo4 S3",
"formula_reduced": "Te5Mo4S3",
"formula_anonymous": "A3B4C5",
"energy_above_hull": 3.437187702777777,
"spacegroup": 8
}
]
}