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=elements&page=709",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=707",
"results": [
{
"id": "jvasp-260",
"created_at": "2022-09-04T14:36:46.058516Z",
"updated_at": "2022-09-04T14:36:46.058535Z",
"structure_string": "Pb2 S2\n1.0\n4.245470 0.011778 -0.000000\n-0.012305 4.245469 0.000000\n-0.000000 -0.000000 5.934864\nPb S\n2 2\ndirect\n0.260472 0.760473 0.750057 Pb\n0.760473 0.260474 0.249943 Pb\n0.760527 0.260527 0.749939 S\n0.260526 0.760527 0.250060 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.428353339947577,
"density_atomic": 0.03739334164515475,
"volume": 106.97091578383449,
"volume_molar": 16.104847801908928,
"formula_full": "Pb2 S2",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.3890454099999998,
"spacegroup": 225
},
{
"id": "jvasp-79645",
"created_at": "2022-09-04T14:37:17.873303Z",
"updated_at": "2022-09-04T14:37:17.873324Z",
"structure_string": "Pb2 S2\n1.0\n2.997403 2.979813 -0.215010\n2.997403 -2.979813 -0.215010\n0.854697 0.000000 -6.243965\nPb S\n2 2\ndirect\n0.212585 0.212585 0.234058 Pb\n0.787414 0.787414 0.765943 Pb\n0.691181 0.691181 0.212805 S\n0.308818 0.308818 0.787195 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.194805446105705,
"density_atomic": 0.036217692643919025,
"volume": 110.44325874999116,
"volume_molar": 16.62762125463871,
"formula_full": "Pb2 S2",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4327854099999999,
"spacegroup": 12
},
{
"id": "jvasp-13762",
"created_at": "2022-09-04T14:38:06.788530Z",
"updated_at": "2022-09-04T14:38:06.788547Z",
"structure_string": "Pb2 S2\n1.0\n4.245356 0.012034 -0.000000\n-0.012048 4.245357 -0.000000\n-0.000000 0.000000 5.934369\nPb S\n2 2\ndirect\n0.260559 0.760560 0.750057 Pb\n0.760560 0.260559 0.249943 Pb\n0.760441 0.260440 0.749962 S\n0.260441 0.760441 0.250038 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.4293684138801614,
"density_atomic": 0.03739845139217663,
"volume": 106.95630035731261,
"volume_molar": 16.102647398014373,
"formula_full": "Pb2 S2",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.38907541,
"spacegroup": 225
},
{
"id": "jvasp-17941",
"created_at": "2022-09-04T14:38:13.889494Z",
"updated_at": "2022-09-04T14:38:13.889521Z",
"structure_string": "Pb1 S1\n1.0\n3.642809 0.000000 0.000000\n0.000000 3.642809 0.000000\n-0.000000 -0.000000 3.642809\nPb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 8.219001674108629,
"density_atomic": 0.04137336008631649,
"volume": 48.34028456541689,
"volume_molar": 14.555599901569797,
"formula_full": "Pb1 S1",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5152254099999999,
"spacegroup": 221
},
{
"id": "jvasp-91537",
"created_at": "2022-09-04T14:36:21.017149Z",
"updated_at": "2022-09-04T14:36:21.017182Z",
"structure_string": "Pb4 S4\n1.0\n4.099677 0.000000 0.000000\n0.000000 5.647366 5.419833\n0.000000 -5.647366 5.419833\nPb S\n4 4\ndirect\n0.000000 0.344968 0.675264 Pb\n0.000000 0.675264 0.344968 Pb\n0.500000 0.138955 0.138955 Pb\n0.000000 0.825621 0.825621 Pb\n0.500000 0.106776 0.767213 S\n0.500000 0.767213 0.106776 S\n0.000000 0.317769 0.317769 S\n0.500000 0.627633 0.627633 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 6.332523148326409,
"density_atomic": 0.031877078367800356,
"volume": 250.96402837472561,
"volume_molar": 18.891758807115398,
"formula_full": "Pb4 S4",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.50386541,
"spacegroup": 38
},
{
"id": "jvasp-79657",
"created_at": "2022-09-04T14:36:44.193319Z",
"updated_at": "2022-09-04T14:36:44.193344Z",
"structure_string": "Pb2 S2\n1.0\n3.001894 3.001943 -0.017179\n3.001894 -3.001943 -0.017179\n-0.033560 -0.000000 -5.934281\nPb S\n2 2\ndirect\n0.249849 0.249849 0.750002 Pb\n0.750150 0.750150 0.249999 Pb\n0.749891 0.749891 0.749983 S\n0.250108 0.250108 0.250017 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.4293071671747235,
"density_atomic": 0.03739814308441631,
"volume": 106.9571820978135,
"volume_molar": 16.102780147149627,
"formula_full": "Pb2 S2",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.3890804099999998,
"spacegroup": 225
},
{
"id": "jvasp-28356",
"created_at": "2022-09-04T14:35:58.036488Z",
"updated_at": "2022-09-04T14:35:58.036518Z",
"structure_string": "Pb2 S2\n1.0\n4.122223 0.000000 0.000000\n-2.061112 3.569886 0.000000\n0.000000 0.000000 7.481065\nPb S\n2 2\ndirect\n-0.000003 -0.000005 0.480580 Pb\n0.000003 0.000005 0.980580 Pb\n0.333329 0.666659 0.698619 S\n0.666671 0.333342 0.198620 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.21786922693483,
"density_atomic": 0.036333792645723534,
"volume": 110.0903513982815,
"volume_molar": 16.57448981095785,
"formula_full": "Pb2 S2",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4289354099999999,
"spacegroup": 186
},
{
"id": "jvasp-21",
"created_at": "2022-09-04T14:37:11.370437Z",
"updated_at": "2022-09-04T14:37:11.370447Z",
"structure_string": "Pb1 Se1\n1.0\n3.791545 0.000000 2.189050\n1.263848 3.574703 2.189050\n0.000000 0.000000 4.378099\nPb Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500001 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 8.00785622631177,
"density_atomic": 0.033704527115849335,
"volume": 59.339209629780356,
"volume_molar": 17.86745364888424,
"formula_full": "Pb1 Se1",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2481820933333333,
"spacegroup": 225
},
{
"id": "jvasp-1115",
"created_at": "2022-09-04T14:37:15.723685Z",
"updated_at": "2022-09-04T14:37:15.723722Z",
"structure_string": "Pb1 Se1\n1.0\n3.791486 0.000000 2.189016\n1.263828 3.574647 2.189016\n0.000000 0.000000 4.378031\nPb Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500001 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 8.008230672778998,
"density_atomic": 0.033706103135791685,
"volume": 59.336435064670795,
"volume_molar": 17.866618207802365,
"formula_full": "Pb1 Se1",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2481820933333333,
"spacegroup": 225
},
{
"id": "jvasp-123692",
"created_at": "2022-09-04T14:38:52.871000Z",
"updated_at": "2022-09-04T14:38:52.871016Z",
"structure_string": "Pb1 Se2\n1.0\n2.397684 -3.996667 -0.897470\n2.262376 3.918547 -0.000001\n-1.161625 0.670664 5.756253\nPb Se\n1 2\ndirect\n0.000000 0.333365 0.166667 Pb\n0.811598 0.739117 0.444196 Se\n0.188403 -0.072481 0.889137 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 6.021804947402711,
"density_atomic": 0.029796360403474727,
"volume": 100.68343782182714,
"volume_molar": 20.210994492125028,
"formula_full": "Pb1 Se2",
"formula_reduced": "PbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 12
},
{
"id": "jvasp-79490",
"created_at": "2022-09-04T14:36:43.011580Z",
"updated_at": "2022-09-04T14:36:43.011608Z",
"structure_string": "Pb2 Se2\n1.0\n-4.301447 0.000000 0.000000\n0.000000 0.000000 -4.485391\n2.150723 -6.055524 -0.000000\nPb Se\n2 2\ndirect\n0.629732 0.750000 0.259464 Pb\n0.370269 0.250000 0.740535 Pb\n0.864921 0.750000 0.729839 Se\n0.135080 0.250000 0.270160 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 8.134322880374594,
"density_atomic": 0.0342368167387706,
"volume": 116.83329178995497,
"volume_molar": 17.58966321533153,
"formula_full": "Pb2 Se2",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2726670933333334,
"spacegroup": 63
},
{
"id": "jvasp-91670",
"created_at": "2022-09-04T14:36:10.189939Z",
"updated_at": "2022-09-04T14:36:10.189961Z",
"structure_string": "Pb4 Se4\n1.0\n0.000000 4.377591 0.000000\n0.000000 -0.000000 4.377843\n12.384059 0.000000 0.000000\nPb Se\n4 4\ndirect\n0.250000 0.249647 0.625012 Pb\n0.250000 0.250352 0.125012 Pb\n0.750000 0.750352 0.374988 Pb\n0.750000 0.749647 0.874988 Pb\n0.250000 0.249759 0.875019 Se\n0.250000 0.250241 0.375019 Se\n0.750000 0.750240 0.124981 Se\n0.750000 0.749759 0.624981 Se\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 8.008655971442222,
"density_atomic": 0.03370789318919947,
"volume": 237.33313604314267,
"volume_molar": 17.865669403300434,
"formula_full": "Pb4 Se4",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2478770933333333,
"spacegroup": 225
}
]
}