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=-formula_anonymous&page=124",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=122",
"results": [
{
"id": "jvasp-25655",
"created_at": "2022-09-04T14:37:43.940902Z",
"updated_at": "2022-09-04T14:37:43.940934Z",
"structure_string": "P4 Cl8 O4 F4\n1.0\n0.000000 9.114311 -0.020491\n5.491430 0.000000 0.000000\n0.000000 -4.088694 -8.377938\nP Cl O F\n4 8 4 4\ndirect\n0.445969 0.360792 0.776875 P\n0.554031 0.639208 0.223125 P\n0.945969 0.139208 0.776875 P\n0.054031 0.860792 0.223125 P\n0.606123 0.814698 0.427593 Cl\n0.893878 0.314698 0.572407 Cl\n0.880603 0.099427 0.197121 Cl\n0.393878 0.185302 0.572407 Cl\n0.119397 0.900573 0.802879 Cl\n0.106123 0.685302 0.427593 Cl\n0.619397 0.599427 0.802879 Cl\n0.380603 0.400573 0.197121 Cl\n0.804224 0.038037 0.791314 O\n0.695776 0.538037 0.208686 O\n0.304224 0.461963 0.791314 O\n0.195776 0.961963 0.208686 O\n0.461744 0.839288 0.096091 F\n0.538256 0.160712 0.903909 F\n0.961744 0.660712 0.096091 F\n0.038256 0.339288 0.903909 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"P",
"Cl",
"O",
"F"
],
"chemical_system": "Cl-F-O-P",
"density": 2.165801622472272,
"density_atomic": 0.04764390064293642,
"volume": 419.7809106749776,
"volume_molar": 12.639898662228509,
"formula_full": "P4 Cl8 O4 F4",
"formula_reduced": "PCl2OF",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.8569814834999998,
"spacegroup": 14
},
{
"id": "jvasp-26412",
"created_at": "2022-09-04T14:37:44.361206Z",
"updated_at": "2022-09-04T14:37:44.361233Z",
"structure_string": "Ba2 Bi2 Cl2 O4\n1.0\n0.000000 5.951502 0.000643\n5.772932 0.000000 0.000000\n0.000000 -2.975059 -6.514197\nBa Bi Cl O\n2 2 2 4\ndirect\n0.380169 0.250000 0.760328 Ba\n0.619831 0.750000 0.239673 Ba\n0.077262 0.250000 0.154533 Bi\n0.922737 0.750000 0.845468 Bi\n0.746321 0.250000 0.492630 Cl\n0.253678 0.750000 0.507370 Cl\n0.228387 0.500005 -0.000004 O\n0.771613 0.499995 0.000004 O\n0.228387 -0.000005 -0.000004 O\n0.771613 0.000005 0.000004 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Bi",
"Cl",
"O"
],
"chemical_system": "Ba-Bi-Cl-O",
"density": 6.139942050216134,
"density_atomic": 0.04468250530432014,
"volume": 223.80123790939598,
"volume_molar": 13.477625569526309,
"formula_full": "Ba2 Bi2 Cl2 O4",
"formula_reduced": "BaBiClO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.7538942675000001,
"spacegroup": 63
},
{
"id": "jvasp-57844",
"created_at": "2022-09-04T14:37:19.523060Z",
"updated_at": "2022-09-04T14:37:19.523084Z",
"structure_string": "Tl4 H4 C4 O8\n1.0\n5.762444 0.000000 0.000000\n0.000000 6.708775 0.000000\n0.000000 0.000000 8.016214\nTl H C O\n4 4 4 8\ndirect\n0.496168 0.500069 0.009087 Tl\n0.996168 -0.000069 0.509086 Tl\n0.003832 0.000069 0.009087 Tl\n0.503831 0.499931 0.509086 Tl\n0.500161 0.912237 0.759255 H\n0.499838 0.087764 0.259255 H\n0.000162 0.587764 0.259255 H\n-0.000162 0.412236 0.759255 H\n0.499956 0.921752 0.259108 C\n0.500043 0.078249 0.759108 C\n-0.000044 0.578249 0.759108 C\n0.000044 0.421751 0.259108 C\n0.837328 0.333518 0.336185 O\n0.337329 0.166483 0.836185 O\n0.662670 0.833518 0.336185 O\n0.162671 0.666483 0.836185 O\n0.162656 0.333573 0.181865 O\n0.337343 0.833573 0.181865 O\n0.837343 0.666428 0.681865 O\n0.662656 0.166427 0.681865 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Tl",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Tl",
"density": 5.34549071346449,
"density_atomic": 0.06453729351180076,
"volume": 309.8983380259503,
"volume_molar": 9.331257064411666,
"formula_full": "Tl4 H4 C4 O8",
"formula_reduced": "TlHCO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.53711792,
"spacegroup": 52
},
{
"id": "jvasp-54828",
"created_at": "2022-09-04T14:37:31.217496Z",
"updated_at": "2022-09-04T14:37:31.217513Z",
"structure_string": "Li4 Ca4 Ga4 N8\n1.0\n0.000000 5.794493 -0.005911\n6.931587 0.000000 0.000000\n0.000000 -0.001405 -5.907588\nLi Ca Ga N\n4 4 4 8\ndirect\n0.632941 0.105177 0.588925 Li\n0.367058 0.894823 0.411075 Li\n0.632942 0.394823 0.088925 Li\n0.367057 0.605177 0.911075 Li\n0.021610 0.626998 0.243159 Ca\n0.978389 0.373003 0.756841 Ca\n0.021609 0.873003 0.743159 Ca\n0.978390 0.126998 0.256841 Ca\n0.623940 0.859534 0.080070 Ga\n0.623939 0.640466 0.580070 Ga\n0.376059 0.140466 0.919930 Ga\n0.376059 0.359534 0.419930 Ga\n0.259954 0.135627 0.595658 N\n0.740044 0.635627 0.904342 N\n0.722842 0.111994 0.928265 N\n0.740045 0.864374 0.404342 N\n0.722842 0.388006 0.428265 N\n0.277157 0.888006 0.071735 N\n0.277157 0.611994 0.571735 N\n0.259954 0.364374 0.095658 N\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Ca",
"Ga",
"N"
],
"chemical_system": "Ca-Ga-Li-N",
"density": 4.052149281660943,
"density_atomic": 0.08428912967367055,
"volume": 237.27852069929978,
"volume_molar": 7.144623254878784,
"formula_full": "Li4 Ca4 Ga4 N8",
"formula_reduced": "LiCaGaN2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.982451849,
"spacegroup": 14
},
{
"id": "jvasp-23959",
"created_at": "2022-09-04T14:37:44.721086Z",
"updated_at": "2022-09-04T14:37:44.721098Z",
"structure_string": "Rb4 H8 O4 F4\n1.0\n4.169622 -0.000000 0.000000\n-0.000000 7.957642 0.000000\n0.000000 0.000000 8.363844\nRb H O F\n4 8 4 4\ndirect\n0.750000 0.256215 0.046068 Rb\n0.250000 0.743785 0.953932 Rb\n0.750000 0.756215 0.453932 Rb\n0.250000 0.243785 0.546067 Rb\n0.558756 0.468387 0.764490 H\n0.058756 0.531613 0.235509 H\n0.441244 0.031613 0.264491 H\n0.941244 0.968386 0.735509 H\n0.941244 0.468387 0.764490 H\n0.058756 0.031613 0.264491 H\n0.558756 0.968386 0.735509 H\n0.441244 0.531613 0.235509 H\n0.750000 0.506484 0.701629 O\n0.250000 0.493516 0.298371 O\n0.750000 0.006484 0.798371 O\n0.250000 0.993516 0.201629 O\n0.750000 0.601983 0.140152 F\n0.750000 0.101983 0.359848 F\n0.250000 0.898017 0.640151 F\n0.250000 0.398017 0.859848 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Rb",
"H",
"O",
"F"
],
"chemical_system": "F-H-O-Rb",
"density": 2.9315176893373014,
"density_atomic": 0.07206808617304543,
"volume": 277.5153478056464,
"volume_molar": 8.3561824377298,
"formula_full": "Rb4 H8 O4 F4",
"formula_reduced": "RbH2OF",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.0260047564999997,
"spacegroup": 62
},
{
"id": "jvasp-23223",
"created_at": "2022-09-04T14:37:42.632440Z",
"updated_at": "2022-09-04T14:37:42.632454Z",
"structure_string": "Ce2 Cr2 Se4 O2\n1.0\n3.850095 -0.000097 0.000042\n-1.924711 5.603157 -0.055900\n-0.000417 -0.151280 8.089970\nCe Cr Se O\n2 2 4 2\ndirect\n0.224536 0.449073 0.801287 Ce\n0.775463 0.550927 0.198712 Ce\n-0.000000 0.000000 0.500000 Cr\n0.499999 -0.000000 -0.000000 Cr\n0.360295 0.720601 0.468158 Se\n0.048221 0.096433 0.199881 Se\n0.951777 0.903567 0.800118 Se\n0.639703 0.279399 0.531842 Se\n0.670560 0.341129 0.938004 O\n0.329438 0.658871 0.061996 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ce",
"Cr",
"Se",
"O"
],
"chemical_system": "Ce-Cr-O-Se",
"density": 6.9667650348417185,
"density_atomic": 0.057310422321797214,
"volume": 174.48833204979962,
"volume_molar": 10.507932965815128,
"formula_full": "Ce2 Cr2 Se4 O2",
"formula_reduced": "CeCrSe2O",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.257602626666667,
"spacegroup": 12
},
{
"id": "jvasp-50864",
"created_at": "2022-09-04T14:37:18.439018Z",
"updated_at": "2022-09-04T14:37:18.439034Z",
"structure_string": "K1 Li1 Mn1 S2\n1.0\n0.000000 4.026698 -0.000000\n2.013349 -2.013349 6.546865\n4.026698 0.000000 0.000000\nK Li Mn S\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.500000 0.250000 Li\n0.750000 0.500000 0.750001 Mn\n0.646859 0.293718 0.353141 S\n0.353141 0.706281 0.646860 S\n",
"nsites": 5,
"nelements": 4,
"elements": [
"K",
"Li",
"Mn",
"S"
],
"chemical_system": "K-Li-Mn-S",
"density": 2.58275961895488,
"density_atomic": 0.04710190809489818,
"volume": 106.15281210957085,
"volume_molar": 12.785343531873364,
"formula_full": "K1 Li1 Mn1 S2",
"formula_reduced": "KLiMnS2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.436197048275862,
"spacegroup": 119
},
{
"id": "jvasp-107711",
"created_at": "2022-09-04T14:37:02.478093Z",
"updated_at": "2022-09-04T14:37:02.478112Z",
"structure_string": "Y2 Si2 Ru4 C2\n1.0\n5.889930 -0.010613 0.000000\n-4.656549 3.606653 0.000000\n-0.000000 -0.000000 7.142093\nY Si Ru C\n2 2 4 2\ndirect\n0.547109 0.452891 0.250000 Y\n0.452890 0.547109 0.750000 Y\n0.269025 0.730974 0.250000 Si\n0.730974 0.269026 0.750000 Si\n0.836181 0.163820 0.056307 Ru\n0.163819 0.836180 0.943693 Ru\n0.163819 0.836180 0.556307 Ru\n0.836181 0.163820 0.443693 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Y",
"Si",
"Ru",
"C"
],
"chemical_system": "C-Ru-Si-Y",
"density": 7.265490834073714,
"density_atomic": 0.06606501425657371,
"volume": 151.36604619751463,
"volume_molar": 9.115476364860958,
"formula_full": "Y2 Si2 Ru4 C2",
"formula_reduced": "YSiRu2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.36313301,
"spacegroup": 63
},
{
"id": "jvasp-102728",
"created_at": "2022-09-04T14:36:54.763893Z",
"updated_at": "2022-09-04T14:36:54.763915Z",
"structure_string": "La2 Ge4 Pd2 Rh2\n1.0\n4.423552 -0.000000 0.000000\n0.000000 4.423552 0.000000\n-0.000000 -0.000000 9.909768\nLa Ge Pd Rh\n2 4 2 2\ndirect\n-0.000000 0.500000 0.255276 La\n0.500000 0.000000 0.744725 La\n-0.000000 0.500000 0.867702 Ge\n0.500000 0.000000 0.132298 Ge\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.500000 Ge\n0.500000 0.500000 -0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n-0.000000 0.500000 0.621134 Rh\n0.500000 0.000000 0.378866 Rh\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Ge",
"Pd",
"Rh"
],
"chemical_system": "Ge-La-Pd-Rh",
"density": 8.452207356021752,
"density_atomic": 0.05156965654508197,
"volume": 193.91248012788378,
"volume_molar": 11.67768250450819,
"formula_full": "La2 Ge4 Pd2 Rh2",
"formula_reduced": "LaGe2PdRh",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.5356811200000002,
"spacegroup": 129
},
{
"id": "jvasp-12132",
"created_at": "2022-09-04T14:37:04.979469Z",
"updated_at": "2022-09-04T14:37:04.979495Z",
"structure_string": "Mn4 Sb4 Se8 Br4\n1.0\n3.985118 -0.000000 0.000000\n-0.000000 9.939904 0.000000\n0.000000 0.000000 12.891269\nMn Sb Se Br\n4 4 8 4\ndirect\n0.750000 0.493849 0.762879 Mn\n0.750000 0.993849 0.737121 Mn\n0.250000 0.006151 0.262879 Mn\n0.250000 0.506150 0.237121 Mn\n0.250000 0.810182 0.964222 Sb\n0.750000 0.689817 0.464222 Sb\n0.250000 0.310182 0.535778 Sb\n0.750000 0.189818 0.035778 Sb\n0.750000 0.444791 0.381322 Se\n0.250000 0.055209 0.881322 Se\n0.250000 0.749018 0.322197 Se\n0.750000 0.944791 0.118678 Se\n0.750000 0.250981 0.677803 Se\n0.750000 0.750981 0.822197 Se\n0.250000 0.555208 0.618678 Se\n0.250000 0.249019 0.177803 Se\n0.250000 0.931470 0.610655 Br\n0.250000 0.431470 0.889345 Br\n0.750000 0.068530 0.389345 Br\n0.750000 0.568530 0.110655 Br\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mn",
"Sb",
"Se",
"Br"
],
"chemical_system": "Br-Mn-Sb-Se",
"density": 5.391848420955235,
"density_atomic": 0.03916615599876873,
"volume": 510.64495582943454,
"volume_molar": 15.375879011944185,
"formula_full": "Mn4 Sb4 Se8 Br4",
"formula_reduced": "MnSbSe2Br",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.7311308359425288,
"spacegroup": 62
},
{
"id": "jvasp-102670",
"created_at": "2022-09-04T14:36:53.653048Z",
"updated_at": "2022-09-04T14:36:53.653070Z",
"structure_string": "Tb1 Si2 Ir1 Rh1\n1.0\n3.815231 -0.002402 -4.321527\n-0.547674 3.775718 -4.321527\n0.002080 0.002402 5.764684\nTb Si Ir Rh\n1 2 1 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.621356 0.621356 0.000000 Si\n0.378645 0.378645 0.000000 Si\n0.250001 0.750000 0.500000 Ir\n0.750000 0.250000 0.499999 Rh\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Tb",
"Si",
"Ir",
"Rh"
],
"chemical_system": "Ir-Rh-Si-Tb",
"density": 10.193775515236055,
"density_atomic": 0.06015884267095145,
"volume": 83.11330102123658,
"volume_molar": 10.01039995556277,
"formula_full": "Tb1 Si2 Ir1 Rh1",
"formula_reduced": "TbSi2IrRh",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.02797594,
"spacegroup": 119
},
{
"id": "jvasp-107569",
"created_at": "2022-09-04T14:36:53.711611Z",
"updated_at": "2022-09-04T14:36:53.711628Z",
"structure_string": "Ce1 Zn1 Ag1 P2\n1.0\n4.179698 0.000000 0.000000\n-2.089848 3.619725 0.000000\n0.000000 0.000000 6.763432\nCe Zn Ag P\n1 1 1 2\ndirect\n0.333334 0.666668 0.008829 Ce\n0.666667 0.333334 0.627589 Zn\n0.000000 0.000000 0.364155 Ag\n0.000000 0.000000 0.752884 P\n0.666667 0.333334 0.246543 P\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Ce",
"Zn",
"Ag",
"P"
],
"chemical_system": "Ag-Ce-P-Zn",
"density": 6.090980038230638,
"density_atomic": 0.048863255202293426,
"volume": 102.32637959341935,
"volume_molar": 12.324477227455256,
"formula_full": "Ce1 Zn1 Ag1 P2",
"formula_reduced": "CeZnAgP2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.200068832,
"spacegroup": 156
}
]
}