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=518",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=516",
"results": [
{
"id": "jvasp-110680",
"created_at": "2022-09-04T14:38:36.613043Z",
"updated_at": "2022-09-04T14:38:36.613063Z",
"structure_string": "K2 Ga1 Ag1 Br6\n1.0\n6.546312 -0.000000 3.779515\n2.182104 6.171922 3.779515\n-0.000000 -0.000000 7.559030\nK Ga Ag Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500001 Ag\n0.759239 0.240761 0.240762 Br\n0.240761 0.240761 0.759239 Br\n0.240761 0.759239 0.759240 Br\n0.240761 0.759239 0.240762 Br\n0.759239 0.240761 0.759240 Br\n0.759238 0.759239 0.240762 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Ga",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ga-K",
"density": 3.9974069967962875,
"density_atomic": 0.03274287439080168,
"volume": 305.4099612833398,
"volume_molar": 18.392217763544227,
"formula_full": "K2 Ga1 Ag1 Br6",
"formula_reduced": "K2GaAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-37302",
"created_at": "2022-09-04T14:37:50.209535Z",
"updated_at": "2022-09-04T14:37:50.209547Z",
"structure_string": "Sm6 Sc2\n1.0\n3.546509 -6.142733 0.000000\n3.546509 6.142733 -0.000000\n0.000000 0.000000 5.607433\nSm Sc\n6 2\ndirect\n0.660267 0.830134 0.250000 Sm\n0.169867 0.830133 0.250000 Sm\n0.169867 0.339733 0.250000 Sm\n0.830134 0.660267 0.750000 Sm\n0.830133 0.169867 0.750000 Sm\n0.339733 0.169867 0.750000 Sm\n0.666667 0.333333 0.250000 Sc\n0.333333 0.666667 0.750000 Sc\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sm",
"Sc"
],
"chemical_system": "Sc-Sm",
"density": 6.742724558028035,
"density_atomic": 0.03274411019530058,
"volume": 244.3187477773684,
"volume_molar": 18.39152361777812,
"formula_full": "Sm6 Sc2",
"formula_reduced": "Sm3Sc",
"formula_anonymous": "AB3",
"energy_above_hull": 1.80461796875,
"spacegroup": 194
},
{
"id": "jvasp-18037",
"created_at": "2022-09-04T14:38:16.389472Z",
"updated_at": "2022-09-04T14:38:16.389486Z",
"structure_string": "Nd4 In2\n1.0\n2.768089 -4.794471 -0.000000\n2.768089 4.794471 -0.000000\n-0.000000 -0.000000 6.903343\nNd In\n4 2\ndirect\n0.000000 0.000000 0.500000 Nd\n0.000000 0.000000 0.000000 Nd\n0.333333 0.666667 0.750000 Nd\n0.666667 0.333333 0.250000 Nd\n0.666667 0.333333 0.750000 In\n0.333333 0.666667 0.250000 In\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nd",
"In"
],
"chemical_system": "In-Nd",
"density": 7.309695320571031,
"density_atomic": 0.032744703087317535,
"volume": 183.23574301468872,
"volume_molar": 18.391190611627373,
"formula_full": "Nd4 In2",
"formula_reduced": "Nd2In",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7400530555555556,
"spacegroup": 194
},
{
"id": "jvasp-7785",
"created_at": "2022-09-04T14:36:40.506214Z",
"updated_at": "2022-09-04T14:36:40.506226Z",
"structure_string": "Sn2 S2\n1.0\n3.549003 0.000000 -1.276157\n0.000000 5.788096 -0.000000\n0.118811 -0.000000 5.903394\nSn S\n2 2\ndirect\n0.851231 0.250000 0.702463 Sn\n0.148768 0.750000 0.297535 Sn\n0.189161 0.250000 0.378322 S\n0.810838 0.750000 0.621676 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 4.099519349185959,
"density_atomic": 0.032747978879354066,
"volume": 122.14494258519863,
"volume_molar": 18.38935093425461,
"formula_full": "Sn2 S2",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5481858500000002,
"spacegroup": 63
},
{
"id": "jvasp-81991",
"created_at": "2022-09-04T14:37:17.871043Z",
"updated_at": "2022-09-04T14:37:17.871054Z",
"structure_string": "Sn2 S2\n1.0\n3.548821 -0.000000 -1.276091\n0.000000 5.788660 -0.000000\n0.118658 0.000000 5.902683\nSn S\n2 2\ndirect\n0.851190 0.250000 0.702380 Sn\n0.148810 0.750000 0.297620 Sn\n0.189085 0.250000 0.378169 S\n0.810915 0.750000 0.621830 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 4.099858329512328,
"density_atomic": 0.0327506867384036,
"volume": 122.13484352099346,
"volume_molar": 18.387830484599913,
"formula_full": "Sn2 S2",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5481858500000002,
"spacegroup": 63
},
{
"id": "jvasp-21022",
"created_at": "2022-09-04T14:37:45.572364Z",
"updated_at": "2022-09-04T14:37:45.572391Z",
"structure_string": "Rb4 Sb12 Se20\n1.0\n0.000000 8.735551 0.093966\n13.020719 0.000000 0.000000\n0.000000 -7.629945 -9.745382\nRb Sb Se\n4 12 20\ndirect\n0.322328 0.750488 0.700197 Rb\n0.677672 0.250487 0.799802 Rb\n0.677672 0.249513 0.299803 Rb\n0.322328 0.749513 0.200197 Rb\n0.735319 0.899398 0.125545 Sb\n0.264681 0.399398 0.374454 Sb\n0.264681 0.100602 0.874454 Sb\n0.134755 0.437312 0.957165 Sb\n0.865245 0.937312 0.542834 Sb\n0.735319 0.600602 0.625545 Sb\n0.134755 0.062688 0.457165 Sb\n0.181220 0.460290 0.677951 Sb\n0.818780 0.960290 0.822049 Sb\n0.818780 0.539710 0.322049 Sb\n0.181220 0.039710 0.177951 Sb\n0.865244 0.562688 0.042835 Sb\n0.897476 0.127014 0.643732 Se\n0.597003 0.982293 0.283877 Se\n0.402997 0.482293 0.216123 Se\n0.370666 0.357731 0.911901 Se\n0.629334 0.857731 0.588098 Se\n0.629333 0.642269 0.088098 Se\n0.370666 0.142269 0.411901 Se\n0.102524 0.627014 0.856268 Se\n0.897476 0.372986 0.143732 Se\n0.178210 0.309278 0.536399 Se\n0.813600 0.408495 0.600243 Se\n0.186400 0.908495 0.899756 Se\n0.186399 0.591505 0.399756 Se\n0.813600 0.091505 0.100243 Se\n0.821790 0.690722 0.463601 Se\n0.178210 0.190722 0.036399 Se\n0.597003 0.517707 0.783877 Se\n0.821790 0.809278 0.963601 Se\n0.102524 0.872986 0.356268 Se\n0.402997 0.017707 0.716123 Se\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Rb",
"Sb",
"Se"
],
"chemical_system": "Rb-Sb-Se",
"density": 5.1097085417295816,
"density_atomic": 0.032753021984509245,
"volume": 1099.1352192486677,
"volume_molar": 18.386519457191493,
"formula_full": "Rb4 Sb12 Se20",
"formula_reduced": "RbSb3Se5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.373477237037037,
"spacegroup": 14
},
{
"id": "jvasp-78444",
"created_at": "2022-09-04T14:37:15.455235Z",
"updated_at": "2022-09-04T14:37:15.455265Z",
"structure_string": "Sr1 U1\n1.0\n-1.639823 -2.840258 0.000000\n1.639823 -2.840258 0.000000\n0.000000 -1.893505 6.555180\nSr U\n1 1\ndirect\n0.854550 0.854550 0.436351 Sr\n0.683451 0.683451 -0.050351 U\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sr",
"U"
],
"chemical_system": "Sr-U",
"density": 8.855831483825348,
"density_atomic": 0.03275371857431735,
"volume": 61.0617690770607,
"volume_molar": 18.38612842183374,
"formula_full": "Sr1 U1",
"formula_reduced": "SrU",
"formula_anonymous": "AB",
"energy_above_hull": 2.297476155,
"spacegroup": 160
},
{
"id": "jvasp-111298",
"created_at": "2022-09-04T14:38:49.334325Z",
"updated_at": "2022-09-04T14:38:49.334349Z",
"structure_string": "Th3 Mg1\n1.0\n4.502235 -0.015562 -4.141312\n-0.877531 4.415914 -4.141312\n0.012819 0.015562 6.117223\nTh Mg\n3 1\ndirect\n0.500000 0.500000 -0.000000 Th\n0.749999 0.250000 0.500000 Th\n0.250000 0.749999 0.500000 Th\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Th",
"Mg"
],
"chemical_system": "Mg-Th",
"density": 9.796141933178848,
"density_atomic": 0.03275523322237396,
"volume": 122.11789098994231,
"volume_molar": 18.38527822139421,
"formula_full": "Th3 Mg1",
"formula_reduced": "Th3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3114939625,
"spacegroup": 139
},
{
"id": "jvasp-29123",
"created_at": "2022-09-04T14:37:09.171999Z",
"updated_at": "2022-09-04T14:37:09.172008Z",
"structure_string": "Te4 Mo4 Se4\n1.0\n3.444453 -0.000000 -0.000001\n-1.722227 2.982974 -0.000010\n-0.000010 -0.000140 35.655793\nTe Mo Se\n4 4 4\ndirect\n0.333348 0.666688 0.710749 Te\n0.666650 0.333311 0.040709 Te\n0.666652 0.333314 0.144937 Te\n0.333346 0.666685 0.606521 Te\n0.333316 0.666643 0.092778 Mo\n0.333355 0.666716 0.466461 Mo\n0.666642 0.333283 0.284997 Mo\n0.666681 0.333356 0.658680 Mo\n0.333316 0.666629 0.330855 Se\n0.666682 0.333368 0.420603 Se\n0.666690 0.333383 0.512354 Se\n0.333308 0.666615 0.239104 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Te",
"Mo",
"Se"
],
"chemical_system": "Mo-Se-Te",
"density": 5.484469641712731,
"density_atomic": 0.03275528745893027,
"volume": 366.3530663574857,
"volume_molar": 18.38524777885333,
"formula_full": "Te4 Mo4 Se4",
"formula_reduced": "TeMoSe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3178323444444446,
"spacegroup": 164
},
{
"id": "jvasp-97799",
"created_at": "2022-09-04T14:35:41.207649Z",
"updated_at": "2022-09-04T14:35:41.207675Z",
"structure_string": "Ba8 Ge16\n1.0\n6.850665 -0.000000 0.000000\n0.000000 9.151330 0.000000\n0.000000 0.000000 11.686962\nBa Ge\n8 16\ndirect\n0.750000 0.985165 0.308454 Ba\n0.750000 0.485165 0.191546 Ba\n0.250000 0.514835 0.808454 Ba\n0.750000 0.155869 0.906986 Ba\n0.250000 0.844131 0.093014 Ba\n0.750000 0.655869 0.593014 Ba\n0.250000 0.344131 0.406986 Ba\n0.250000 0.014835 0.691546 Ba\n0.250000 0.694612 0.541330 Ge\n0.750000 0.305388 0.458670 Ge\n0.250000 0.194612 0.958670 Ge\n0.750000 0.805388 0.041330 Ge\n0.938040 0.307824 0.649511 Ge\n0.250000 0.426319 0.092642 Ge\n0.750000 0.573681 0.907358 Ge\n0.938040 0.807824 0.850489 Ge\n0.438040 0.192176 0.149511 Ge\n0.561961 0.307824 0.649511 Ge\n0.061961 0.692176 0.350489 Ge\n0.061961 0.192176 0.149511 Ge\n0.561961 0.807824 0.850489 Ge\n0.438040 0.692176 0.350489 Ge\n0.750000 0.073681 0.592642 Ge\n0.250000 0.926319 0.407358 Ge\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Ba",
"Ge"
],
"chemical_system": "Ba-Ge",
"density": 5.123932737233727,
"density_atomic": 0.03275613576350601,
"volume": 732.6871574008641,
"volume_molar": 18.38477164546783,
"formula_full": "Ba8 Ge16",
"formula_reduced": "BaGe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.29250865,
"spacegroup": 62
},
{
"id": "jvasp-11206",
"created_at": "2022-09-04T14:37:09.202985Z",
"updated_at": "2022-09-04T14:37:09.202994Z",
"structure_string": "Rb4 V2 Ag2 Se8\n1.0\n5.819176 -0.000000 1.458017\n2.909588 6.848725 0.729008\n0.020318 0.000000 12.260542\nRb V Ag Se\n4 2 2 8\ndirect\n0.942878 0.750001 0.114245 Rb\n0.307123 0.750001 0.385756 Rb\n0.692878 0.250000 0.614244 Rb\n0.057123 0.250000 0.885755 Rb\n0.875001 0.250000 0.250000 V\n0.125000 0.750001 0.750000 V\n0.375000 0.250000 0.250000 Ag\n0.625001 0.750001 0.750000 Ag\n0.074983 0.547772 0.633879 Se\n0.756635 0.952229 0.866121 Se\n0.622755 0.452229 0.133880 Se\n0.708863 0.047771 0.366121 Se\n0.377246 0.547772 0.866120 Se\n0.291138 0.952229 0.633880 Se\n0.243366 0.047771 0.133880 Se\n0.925018 0.452229 0.366121 Se\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"V",
"Ag",
"Se"
],
"chemical_system": "Ag-Rb-Se-V",
"density": 4.389673294991466,
"density_atomic": 0.03275815664574403,
"volume": 488.427971482905,
"volume_molar": 18.383637471195748,
"formula_full": "Rb4 V2 Ag2 Se8",
"formula_reduced": "Rb2VAgSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.0187293658333334,
"spacegroup": 70
},
{
"id": "jvasp-117536",
"created_at": "2022-09-04T14:38:45.983844Z",
"updated_at": "2022-09-04T14:38:45.983871Z",
"structure_string": "Ba1 Cu1 Br2\n1.0\n4.413407 0.000000 -0.000000\n-0.000000 4.413407 -0.000000\n0.000000 -0.000000 6.268850\nBa Cu Br\n1 1 2\ndirect\n0.500001 0.500001 0.583846 Ba\n0.000000 0.000000 0.956445 Cu\n0.000000 0.000000 0.400085 Br\n0.500001 0.500001 0.069622 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"Br"
],
"chemical_system": "Ba-Br-Cu",
"density": 4.904971918396227,
"density_atomic": 0.03275851106838139,
"volume": 122.10567176420945,
"volume_molar": 18.383438573960667,
"formula_full": "Ba1 Cu1 Br2",
"formula_reduced": "BaCuBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0200174999999999,
"spacegroup": 99
}
]
}