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=chemical_system&page=47",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=45",
"results": [
{
"id": "jvasp-111114",
"created_at": "2022-09-04T14:38:38.213565Z",
"updated_at": "2022-09-04T14:38:38.213582Z",
"structure_string": "Ag2 Bi1 Sb1 Se4\n1.0\n5.322373 0.020124 -4.813091\n-1.035718 5.220666 -4.813091\n-0.016460 -0.020124 7.175878\nAg Bi Sb Se\n2 1 1 4\ndirect\n0.499999 0.500000 -0.000000 Ag\n0.250000 0.750001 0.500001 Ag\n0.749999 0.250000 0.500000 Bi\n0.000000 0.000000 0.000000 Sb\n0.497068 0.997069 0.500001 Se\n0.247196 0.247196 -0.000000 Se\n0.002931 0.502932 0.500001 Se\n0.752803 0.752804 -0.000000 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ag",
"Bi",
"Sb",
"Se"
],
"chemical_system": "Ag-Bi-Sb-Se",
"density": 7.213181838556533,
"density_atomic": 0.040299617378925755,
"volume": 198.51305099942493,
"volume_molar": 14.943419197694945,
"formula_full": "Ag2 Bi1 Sb1 Se4",
"formula_reduced": "Ag2BiSbSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.0700247983333333,
"spacegroup": 119
},
{
"id": "jvasp-109207",
"created_at": "2022-09-04T14:38:20.683384Z",
"updated_at": "2022-09-04T14:38:20.683410Z",
"structure_string": "Ag2 Bi1 Sb1 Te2 Se2\n1.0\n5.521331 0.027801 -4.887250\n-1.086100 5.383003 -4.920848\n-0.023031 -0.027801 7.373586\nAg Bi Sb Te Se\n2 1 1 2 2\ndirect\n0.995969 0.995968 -0.000001 Ag\n0.245991 0.745991 0.500000 Ag\n0.763149 0.263149 0.500000 Bi\n0.511841 0.511840 -0.000001 Sb\n0.243250 0.243249 -0.000000 Te\n0.492139 0.992139 0.499999 Te\n0.744657 0.744657 -0.000001 Se\n0.003004 0.503003 0.500000 Se\n",
"nsites": 8,
"nelements": 5,
"elements": [
"Ag",
"Bi",
"Sb",
"Te",
"Se"
],
"chemical_system": "Ag-Bi-Sb-Se-Te",
"density": 7.313760932647104,
"density_atomic": 0.03671917024867993,
"volume": 217.86984688978922,
"volume_molar": 16.400536066624483,
"formula_full": "Ag2 Bi1 Sb1 Te2 Se2",
"formula_reduced": "Ag2BiSb(TeSe)2",
"formula_anonymous": "ABC2D2E2",
"energy_above_hull": 0.9409421483333332,
"spacegroup": 44
},
{
"id": "jvasp-101752",
"created_at": "2022-09-04T14:36:49.166420Z",
"updated_at": "2022-09-04T14:36:49.166450Z",
"structure_string": "Ag2 Bi1 Sb1 Te4\n1.0\n5.648529 0.013516 -5.028764\n-1.127922 5.534785 -5.028764\n-0.011013 -0.013516 7.562686\nAg Bi Sb Te\n2 1 1 4\ndirect\n0.500000 0.500001 0.000001 Ag\n0.250001 0.750000 0.500001 Ag\n0.000000 0.000000 0.000000 Bi\n0.750001 0.250000 0.500001 Sb\n0.002484 0.502483 0.500001 Te\n0.743191 0.743192 0.000002 Te\n0.497518 0.997518 0.500002 Te\n0.256810 0.256810 0.000001 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ag",
"Bi",
"Sb",
"Te"
],
"chemical_system": "Ag-Bi-Sb-Te",
"density": 7.443185475922091,
"density_atomic": 0.03392933644056193,
"volume": 235.78415728862117,
"volume_molar": 17.74906730212571,
"formula_full": "Ag2 Bi1 Sb1 Te4",
"formula_reduced": "Ag2BiSbTe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.8079857483333335,
"spacegroup": 119
},
{
"id": "jvasp-34889",
"created_at": "2022-09-04T14:38:34.281584Z",
"updated_at": "2022-09-04T14:38:34.281610Z",
"structure_string": "Ag3 Bi3 Se6\n1.0\n2.096436 -3.631135 0.000000\n2.096436 3.631135 -0.000000\n-0.000000 -0.000000 19.771433\nAg Bi Se\n3 3 6\ndirect\n0.333334 0.666668 0.333315 Ag\n0.666668 0.333334 0.666685 Ag\n0.000000 0.000000 0.000000 Ag\n0.333334 0.666668 0.833345 Bi\n0.000000 0.000000 0.500000 Bi\n0.666668 0.333334 0.166655 Bi\n0.666668 0.333334 0.411631 Se\n0.333334 0.666668 0.588369 Se\n0.666668 0.333334 0.921708 Se\n0.333334 0.666668 0.078292 Se\n0.000000 0.000000 0.744980 Se\n0.000000 0.000000 0.255020 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"Se"
],
"chemical_system": "Ag-Bi-Se",
"density": 7.857062228711726,
"density_atomic": 0.03986475492922897,
"volume": 301.0177792715229,
"volume_molar": 15.106428650297676,
"formula_full": "Ag3 Bi3 Se6",
"formula_reduced": "AgBiSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7808470733333334,
"spacegroup": 166
},
{
"id": "jvasp-8778",
"created_at": "2022-09-04T14:36:47.352066Z",
"updated_at": "2022-09-04T14:36:47.352077Z",
"structure_string": "Ag2 Bi2 Se4\n1.0\n8.284293 0.000182 0.000094\n8.284457 7.207183 0.023143\n4.142298 4.815628 3.404802\nAg Bi Se\n2 2 4\ndirect\n0.499950 -0.000039 0.000132 Ag\n0.250050 0.500040 0.999866 Ag\n-0.000015 0.000014 0.000012 Bi\n0.750015 0.499986 -0.000014 Bi\n0.252343 0.000027 0.495280 Se\n0.747657 -0.000081 0.504808 Se\n0.497657 0.499975 0.504718 Se\n0.002343 0.500082 0.495190 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"Se"
],
"chemical_system": "Ag-Bi-Se",
"density": 7.791733448862454,
"density_atomic": 0.03953329315347773,
"volume": 202.36108256759894,
"volume_molar": 15.233086544600788,
"formula_full": "Ag2 Bi2 Se4",
"formula_reduced": "AgBiSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7924220733333334,
"spacegroup": 141
},
{
"id": "jvasp-106854",
"created_at": "2022-09-04T14:38:45.921826Z",
"updated_at": "2022-09-04T14:38:45.921860Z",
"structure_string": "Ag2 Sn1 Bi1 Se4\n1.0\n4.055200 -0.018899 13.035170\n1.965033 3.547344 13.035170\n-0.032246 -0.018899 13.651347\nAg Sn Bi Se\n2 1 1 4\ndirect\n0.506741 0.506741 0.506743 Ag\n0.242056 0.242056 0.242057 Ag\n0.757400 0.757399 0.757403 Sn\n0.995360 0.995359 0.995364 Bi\n0.874746 0.874746 0.874750 Se\n0.618888 0.618887 0.618890 Se\n0.374280 0.374280 0.374282 Se\n0.130525 0.130525 0.130525 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ag",
"Sn",
"Bi",
"Se"
],
"chemical_system": "Ag-Bi-Se-Sn",
"density": 7.173754004865577,
"density_atomic": 0.0402215995402999,
"volume": 198.89810677430734,
"volume_molar": 14.972404948654853,
"formula_full": "Ag2 Sn1 Bi1 Se4",
"formula_reduced": "Ag2SnBiSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.8907467483333333,
"spacegroup": 160
},
{
"id": "jvasp-18802",
"created_at": "2022-09-04T14:36:46.422060Z",
"updated_at": "2022-09-04T14:36:46.422091Z",
"structure_string": "Sr2 Ag2 Bi2\n1.0\n2.464526 -4.268684 -0.000000\n2.464526 4.268684 -0.000000\n0.000000 -0.000000 8.631451\nSr Ag Bi\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.666668 0.333334 0.750000 Ag\n0.333334 0.666668 0.250000 Ag\n0.666668 0.333334 0.250000 Bi\n0.333334 0.666668 0.750000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Ag",
"Bi"
],
"chemical_system": "Ag-Bi-Sr",
"density": 7.3964391617786465,
"density_atomic": 0.03303771746711634,
"volume": 181.61060932771827,
"volume_molar": 18.228077548014806,
"formula_full": "Sr2 Ag2 Bi2",
"formula_reduced": "SrAgBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-109799",
"created_at": "2022-09-04T14:38:16.820386Z",
"updated_at": "2022-09-04T14:38:16.820419Z",
"structure_string": "Ag2 Bi2 Se1 S3\n1.0\n5.255809 0.005153 -4.682387\n-1.004397 5.062607 -4.786386\n-0.007033 -0.005153 7.039050\nAg Bi Se S\n2 2 1 3\ndirect\n0.993459 0.993460 -0.000001 Ag\n0.252351 0.752351 0.500000 Ag\n0.505022 0.505023 -0.000001 Bi\n0.752772 0.252771 0.500000 Bi\n0.245910 0.245910 -0.000000 Se\n0.503545 0.003544 0.500000 S\n0.749110 0.749111 -0.000001 S\n0.997831 0.497831 0.499999 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ag",
"Bi",
"Se",
"S"
],
"chemical_system": "Ag-Bi-S-Se",
"density": 7.182066230330675,
"density_atomic": 0.04277806383083651,
"volume": 187.01173647399187,
"volume_molar": 14.077637510230065,
"formula_full": "Ag2 Bi2 Se1 S3",
"formula_reduced": "Ag2Bi2SeS3",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 1.1803145608333334,
"spacegroup": 44
},
{
"id": "jvasp-110292",
"created_at": "2022-09-04T14:38:18.191053Z",
"updated_at": "2022-09-04T14:38:18.191072Z",
"structure_string": "Ag1 Bi1 Se1 S1\n1.0\n4.038335 0.000000 0.000000\n0.000000 4.038335 0.000000\n0.000000 0.000000 5.855637\nAg Bi Se S\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.499999 0.499999 0.500000 Bi\n0.499999 0.499999 -0.000000 Se\n0.000000 0.000000 0.500000 S\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Ag",
"Bi",
"Se",
"S"
],
"chemical_system": "Ag-Bi-S-Se",
"density": 7.440219638944848,
"density_atomic": 0.04188718347336808,
"volume": 95.49460403665489,
"volume_molar": 14.37704868323,
"formula_full": "Ag1 Bi1 Se1 S1",
"formula_reduced": "AgBiSeS",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.9222387316666668,
"spacegroup": 123
},
{
"id": "jvasp-108166",
"created_at": "2022-09-04T14:38:16.019053Z",
"updated_at": "2022-09-04T14:38:16.019080Z",
"structure_string": "Ag2 Sn1 Bi1 S4\n1.0\n5.089343 0.003392 -4.642317\n-0.989181 4.992289 -4.642317\n-0.002784 -0.003392 6.888578\nAg Sn Bi S\n2 1 1 4\ndirect\n0.500000 0.500000 -0.000001 Ag\n0.250001 0.750000 0.500000 Ag\n0.000000 0.000000 0.000000 Sn\n0.750000 0.250000 0.500000 Bi\n0.498698 0.998698 0.500000 S\n0.247285 0.247285 -0.000000 S\n0.001303 0.501303 0.500001 S\n0.752715 0.752715 -0.000001 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ag",
"Sn",
"Bi",
"S"
],
"chemical_system": "Ag-Bi-S-Sn",
"density": 6.377715979896389,
"density_atomic": 0.04574453852183511,
"volume": 174.88426506218622,
"volume_molar": 13.164720761420444,
"formula_full": "Ag2 Sn1 Bi1 S4",
"formula_reduced": "Ag2SnBiS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.178240065,
"spacegroup": 119
},
{
"id": "jvasp-111112",
"created_at": "2022-09-04T14:38:37.020212Z",
"updated_at": "2022-09-04T14:38:37.020240Z",
"structure_string": "Ag1 Bi1 Te2\n1.0\n4.421144 0.000000 0.000000\n0.000000 4.421144 0.000000\n0.000000 0.000000 6.203489\nAg Bi Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Te\n0.500000 0.500000 -0.000000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"Te"
],
"chemical_system": "Ag-Bi-Te",
"density": 7.833875896032006,
"density_atomic": 0.03298789883137839,
"volume": 121.25658625444683,
"volume_molar": 18.255605762534,
"formula_full": "Ag1 Bi1 Te2",
"formula_reduced": "AgBiTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5985967733333334,
"spacegroup": 123
},
{
"id": "jvasp-56537",
"created_at": "2022-09-04T14:37:35.610495Z",
"updated_at": "2022-09-04T14:37:35.610518Z",
"structure_string": "Ag3 Bi3 Te6\n1.0\n2.168844 -3.756548 -0.000000\n2.168844 3.756548 0.000000\n0.000000 -0.000000 21.894435\nAg Bi Te\n3 3 6\ndirect\n0.666666 0.333332 0.360278 Ag\n0.333332 0.666666 0.639723 Ag\n-0.000000 -0.000000 0.500000 Ag\n0.333332 0.666666 0.192464 Bi\n0.666666 0.333332 0.807536 Bi\n0.000000 0.000000 0.000000 Bi\n0.666666 0.333332 0.091462 Te\n0.333332 0.666666 0.908538 Te\n0.666666 0.333332 0.574754 Te\n0.333332 0.666666 0.425246 Te\n-0.000000 -0.000000 0.278826 Te\n-0.000000 -0.000000 0.721174 Te\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"Te"
],
"chemical_system": "Ag-Bi-Te",
"density": 7.987709894491007,
"density_atomic": 0.03363568294812225,
"volume": 356.76397647427325,
"volume_molar": 17.90402403687835,
"formula_full": "Ag3 Bi3 Te6",
"formula_reduced": "AgBiTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5943992733333334,
"spacegroup": 164
}
]
}