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=-structure_string&page=669",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=667",
"results": [
{
"id": "jvasp-93876",
"created_at": "2022-09-04T14:36:14.981633Z",
"updated_at": "2022-09-04T14:36:14.981659Z",
"structure_string": "Th2 Si2 S2\n1.0\n3.925325 0.000000 0.000000\n0.000000 3.925325 0.000000\n-1.962662 -1.962662 8.622548\nTh Si S\n2 2 2\ndirect\n0.861975 0.861975 0.723951 Th\n0.138025 0.138025 0.276049 Th\n0.499999 -0.000000 -0.000000 Si\n-0.000000 0.499999 -0.000000 Si\n0.688406 0.688406 0.376815 S\n0.311593 0.311593 0.623185 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"S"
],
"chemical_system": "S-Si-Th",
"density": 7.303910451802029,
"density_atomic": 0.04516108726610037,
"volume": 132.85774021884163,
"volume_molar": 13.334800210889624,
"formula_full": "Th2 Si2 S2",
"formula_reduced": "ThSiS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.010414733333333,
"spacegroup": 139
},
{
"id": "jvasp-102302",
"created_at": "2022-09-04T14:36:42.237989Z",
"updated_at": "2022-09-04T14:36:42.238010Z",
"structure_string": "Th2 Si2 Ru4 C2\n1.0\n5.971211 -0.005276 0.000000\n-4.662455 3.730537 0.000000\n-0.000000 0.000000 7.191392\nTh Si Ru C\n2 2 4 2\ndirect\n0.554440 0.445560 0.250000 Th\n0.445560 0.554440 0.750000 Th\n0.273663 0.726338 0.250000 Si\n0.726337 0.273662 0.750000 Si\n0.835641 0.164358 0.055847 Ru\n0.164360 0.835642 0.944153 Ru\n0.164360 0.835642 0.555847 Ru\n0.835641 0.164358 0.444153 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Th",
"Si",
"Ru",
"C"
],
"chemical_system": "C-Ru-Si-Th",
"density": 9.84332378407878,
"density_atomic": 0.06249325168359699,
"volume": 160.0172775555023,
"volume_molar": 9.636465694712234,
"formula_full": "Th2 Si2 Ru4 C2",
"formula_reduced": "ThSiRu2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.46283704,
"spacegroup": 63
},
{
"id": "jvasp-35344",
"created_at": "2022-09-04T14:37:36.957009Z",
"updated_at": "2022-09-04T14:37:36.957025Z",
"structure_string": "Th2 Si2 Pt2\n1.0\n4.183200 0.000000 0.000000\n0.000000 4.183200 0.000000\n-2.091600 -2.091600 7.411455\nTh Si Pt\n2 2 2\ndirect\n0.580761 0.580761 0.161521 Th\n0.830760 0.330760 0.661521 Th\n-0.000013 -0.000013 -0.000026 Si\n0.249987 0.749987 0.499974 Si\n0.166252 0.166252 0.332504 Pt\n0.416252 0.916252 0.832504 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"Pt"
],
"chemical_system": "Pt-Si-Th",
"density": 11.65649080838235,
"density_atomic": 0.046262651112373855,
"volume": 129.6942534794592,
"volume_molar": 13.017284170273719,
"formula_full": "Th2 Si2 Pt2",
"formula_reduced": "ThSiPt",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3150752,
"spacegroup": 109
},
{
"id": "jvasp-101436",
"created_at": "2022-09-04T14:36:39.658398Z",
"updated_at": "2022-09-04T14:36:39.658420Z",
"structure_string": "Th2 Si2 Os4 C2\n1.0\n5.999283 -0.012831 -0.000000\n-4.661218 3.776849 0.000000\n-0.000000 0.000000 7.208812\nTh Si Os C\n2 2 4 2\ndirect\n0.553560 0.446440 0.250000 Th\n0.446440 0.553560 0.750000 Th\n0.272764 0.727237 0.250000 Si\n0.727236 0.272764 0.750000 Si\n0.835206 0.164794 0.055749 Os\n0.164794 0.835206 0.944250 Os\n0.164794 0.835206 0.555749 Os\n0.835206 0.164794 0.444251 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Th",
"Si",
"Os",
"C"
],
"chemical_system": "C-Os-Si-Th",
"density": 13.303855907686561,
"density_atomic": 0.06138400064577108,
"volume": 162.90889962853748,
"volume_molar": 9.810603246197644,
"formula_full": "Th2 Si2 Os4 C2",
"formula_reduced": "ThSiOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 5.10903284,
"spacegroup": 63
},
{
"id": "jvasp-9741",
"created_at": "2022-09-04T14:37:13.074170Z",
"updated_at": "2022-09-04T14:37:13.074200Z",
"structure_string": "Th2 Si2 O8\n1.0\n5.748533 0.011704 -1.694679\n-3.211412 4.767873 -1.694679\n-0.006212 -0.011704 5.993124\nTh Si O\n2 2 8\ndirect\n0.625000 0.374999 0.249999 Th\n0.375000 0.625000 0.749999 Th\n0.125000 0.875000 0.250000 Si\n0.875000 0.125000 0.749999 Si\n0.136179 0.709160 0.427017 O\n0.709160 0.782143 0.572982 O\n0.709160 0.136179 0.927016 O\n0.782143 0.709159 0.072982 O\n0.290839 0.863821 0.072982 O\n0.217857 0.290840 0.927017 O\n0.863821 0.290839 0.572982 O\n0.290840 0.217857 0.427017 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Th",
"Si",
"O"
],
"chemical_system": "O-Si-Th",
"density": 6.553271877778233,
"density_atomic": 0.07305550621903525,
"volume": 164.25866606168688,
"volume_molar": 8.24324006727761,
"formula_full": "Th2 Si2 O8",
"formula_reduced": "ThSiO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.392034700000001,
"spacegroup": 141
},
{
"id": "jvasp-94302",
"created_at": "2022-09-04T14:36:01.928515Z",
"updated_at": "2022-09-04T14:36:01.928549Z",
"structure_string": "Th2 Si2 Ni2\n1.0\n4.097769 0.000000 0.000000\n0.000000 4.097769 0.000000\n-2.048885 -2.048885 7.045582\nTh Si Ni\n2 2 2\ndirect\n0.248797 0.748797 0.497595 Th\n0.998798 0.998798 0.997594 Th\n0.668157 0.168157 0.336312 Si\n0.418157 0.418157 0.836312 Si\n0.837048 0.337048 0.674094 Ni\n0.587047 0.587047 0.174094 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ni"
],
"chemical_system": "Ni-Si-Th",
"density": 8.949704382671339,
"density_atomic": 0.05071535049903977,
"volume": 118.3073752021807,
"volume_molar": 11.874394440227759,
"formula_full": "Th2 Si2 Ni2",
"formula_reduced": "ThSiNi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.9597322000000004,
"spacegroup": 109
},
{
"id": "jvasp-102629",
"created_at": "2022-09-04T14:36:54.356309Z",
"updated_at": "2022-09-04T14:36:54.356336Z",
"structure_string": "Th2 Si2 Ir2\n1.0\n4.037216 -0.004556 -6.685538\n-0.317058 4.024749 -6.685538\n0.004216 0.004556 7.809962\nTh Si Ir\n2 2 2\ndirect\n0.578235 0.578234 -0.000000 Th\n0.328235 0.828235 0.500000 Th\n0.000279 0.000279 -0.000000 Si\n0.750280 0.250279 0.500000 Si\n0.168486 0.168486 -0.000000 Ir\n0.918487 0.418486 0.500000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Th",
"density": 11.816033357414234,
"density_atomic": 0.04719308133309637,
"volume": 127.13728009516974,
"volume_molar": 12.76064327627764,
"formula_full": "Th2 Si2 Ir2",
"formula_reduced": "ThSiIr",
"formula_anonymous": "ABC",
"energy_above_hull": 2.9401651,
"spacegroup": 109
},
{
"id": "jvasp-91556",
"created_at": "2022-09-04T14:36:01.084949Z",
"updated_at": "2022-09-04T14:36:01.084978Z",
"structure_string": "Th2 Se6\n1.0\n0.000000 -4.244832 0.000000\n-5.776561 0.000000 0.008038\n-1.209371 0.000000 -9.601324\nTh Se\n2 6\ndirect\n0.750000 0.282890 0.341192 Th\n0.250000 0.717110 0.658807 Th\n0.750000 0.763772 0.438511 Se\n0.250000 0.236228 0.561488 Se\n0.750000 0.463768 0.832596 Se\n0.250000 0.536232 0.167404 Se\n0.750000 0.877700 0.844272 Se\n0.250000 0.122299 0.155728 Se\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Th",
"Se"
],
"chemical_system": "Se-Th",
"density": 6.613615536802781,
"density_atomic": 0.0339744847608668,
"volume": 235.47082630712111,
"volume_molar": 17.72548076118743,
"formula_full": "Th2 Se6",
"formula_reduced": "ThSe3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.532158925,
"spacegroup": 11
},
{
"id": "jvasp-2700",
"created_at": "2022-09-04T14:36:49.546071Z",
"updated_at": "2022-09-04T14:36:49.546088Z",
"structure_string": "Th2 Se2 O2\n1.0\n4.047644 0.000000 0.000000\n-0.000000 4.047644 -0.000000\n0.000000 0.000000 7.072029\nTh Se O\n2 2 2\ndirect\n0.499999 0.000000 0.188780 Th\n0.000000 0.499999 0.811221 Th\n0.499999 0.000000 0.636979 Se\n0.000000 0.499999 0.363021 Se\n0.000000 0.000000 0.000000 O\n0.499999 0.499999 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Se",
"O"
],
"chemical_system": "O-Se-Th",
"density": 9.372918115329096,
"density_atomic": 0.05178483549258021,
"volume": 115.86403515484156,
"volume_molar": 11.629158812067404,
"formula_full": "Th2 Se2 O2",
"formula_reduced": "ThSeO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0824741555555557,
"spacegroup": 129
},
{
"id": "jvasp-2631",
"created_at": "2022-09-04T14:36:58.339475Z",
"updated_at": "2022-09-04T14:36:58.339498Z",
"structure_string": "Th2 Se1 N2\n1.0\n2.024220 -3.506051 0.000000\n2.024220 3.506051 0.000000\n0.000000 0.000000 7.199295\nTh Se N\n2 1 2\ndirect\n0.666667 0.333333 0.704546 Th\n0.333333 0.666667 0.295454 Th\n0.000000 0.000000 0.000000 Se\n0.333333 0.666667 0.627651 N\n0.666667 0.333333 0.372350 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Se",
"N"
],
"chemical_system": "N-Se-Th",
"density": 9.27955098444548,
"density_atomic": 0.04892987410026992,
"volume": 102.18706039900515,
"volume_molar": 12.307697231468614,
"formula_full": "Th2 Se1 N2",
"formula_reduced": "Th2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.509576213333333,
"spacegroup": 164
},
{
"id": "jvasp-14888",
"created_at": "2022-09-04T14:36:21.655780Z",
"updated_at": "2022-09-04T14:36:21.655809Z",
"structure_string": "Th2 Sb4\n1.0\n4.420824 0.000000 -0.000000\n0.000000 4.420824 0.000000\n-0.000000 0.000000 9.212310\nTh Sb\n2 4\ndirect\n0.000000 0.500000 0.276097 Th\n0.500000 0.000000 0.723903 Th\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.000000 Sb\n0.000000 0.500000 0.633695 Sb\n0.500000 0.000000 0.366305 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Sb"
],
"chemical_system": "Sb-Th",
"density": 8.772182239266495,
"density_atomic": 0.03332546791583608,
"volume": 180.04248327894695,
"volume_molar": 18.070686284762747,
"formula_full": "Th2 Sb4",
"formula_reduced": "ThSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.6826092666666672,
"spacegroup": 129
},
{
"id": "jvasp-35103",
"created_at": "2022-09-04T14:37:39.893740Z",
"updated_at": "2022-09-04T14:37:39.893769Z",
"structure_string": "Th2 Sb2 Te2\n1.0\n4.455184 0.000000 0.000000\n-0.000000 4.455184 0.000000\n-0.000000 -0.000000 9.185594\nTh Sb Te\n2 2 2\ndirect\n0.500000 0.000000 0.735125 Th\n0.000000 0.500000 0.264875 Th\n0.500000 0.500000 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.000000 0.370315 Te\n0.000000 0.500000 0.629685 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Sb",
"Te"
],
"chemical_system": "Sb-Te-Th",
"density": 8.768895461588304,
"density_atomic": 0.032908850607536164,
"volume": 182.32177329906483,
"volume_molar": 18.299456373662967,
"formula_full": "Th2 Sb2 Te2",
"formula_reduced": "ThSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.387233155555556,
"spacegroup": 129
}
]
}