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=580",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=578",
"results": [
{
"id": "jvasp-40190",
"created_at": "2022-09-04T14:38:31.285790Z",
"updated_at": "2022-09-04T14:38:31.285817Z",
"structure_string": "Ca4 Sn4 S12\n1.0\n3.840883 0.000000 0.000000\n-0.000000 8.171350 0.000000\n0.000000 0.000000 13.818321\nCa Sn S\n4 4 12\ndirect\n0.250000 0.925645 0.318917 Ca\n0.250000 0.425645 0.181083 Ca\n0.749999 0.074355 0.681083 Ca\n0.749999 0.574355 0.818917 Ca\n0.749999 0.322116 0.441477 Sn\n0.749999 0.822116 0.058523 Sn\n0.250000 0.677884 0.558523 Sn\n0.250000 0.177884 0.941477 Sn\n0.749999 0.693356 0.221001 S\n0.749999 0.193356 0.278999 S\n0.749999 0.357694 0.008820 S\n0.749999 0.857694 0.491180 S\n0.250000 0.642306 0.991180 S\n0.250000 0.023024 0.110283 S\n0.749999 0.976976 0.889717 S\n0.749999 0.476976 0.610283 S\n0.250000 0.806644 0.721001 S\n0.250000 0.523024 0.389717 S\n0.250000 0.142306 0.508820 S\n0.250000 0.306644 0.778999 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"S"
],
"chemical_system": "Ca-S-Sn",
"density": 3.905171825021926,
"density_atomic": 0.04611580856448327,
"volume": 433.69075860470286,
"volume_molar": 13.058733973143509,
"formula_full": "Ca4 Sn4 S12",
"formula_reduced": "CaSnS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.974334424,
"spacegroup": 62
},
{
"id": "jvasp-110983",
"created_at": "2022-09-04T14:38:39.066717Z",
"updated_at": "2022-09-04T14:38:39.066736Z",
"structure_string": "Tb1 Bi1 Te3\n1.0\n4.300446 -0.004301 9.878805\n2.053532 3.778473 9.878805\n-0.007241 -0.004301 10.774256\nTb Bi Te\n1 1 3\ndirect\n0.601264 0.601263 0.601262 Tb\n0.399611 0.399610 0.399610 Bi\n0.995957 0.995956 0.995955 Te\n0.787398 0.787397 0.787397 Te\n0.215773 0.215773 0.215773 Te\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Bi",
"Te"
],
"chemical_system": "Bi-Tb-Te",
"density": 7.101647328727529,
"density_atomic": 0.028484609220226817,
"volume": 175.53338932413783,
"volume_molar": 21.141735571796787,
"formula_full": "Tb1 Bi1 Te3",
"formula_reduced": "TbBiTe3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.9132572,
"spacegroup": 160
},
{
"id": "jvasp-114812",
"created_at": "2022-09-04T14:38:43.327054Z",
"updated_at": "2022-09-04T14:38:43.327072Z",
"structure_string": "Rb3 S1 Cl1\n1.0\n6.200016 0.000000 0.000000\n0.000000 6.200016 0.000000\n-0.000000 -0.000000 6.200016\nRb S Cl\n3 1 1\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"S",
"Cl"
],
"chemical_system": "Cl-Rb-S",
"density": 2.2568895596193252,
"density_atomic": 0.020979328029112704,
"volume": 238.32984512476156,
"volume_molar": 28.705117493006277,
"formula_full": "Rb3 S1 Cl1",
"formula_reduced": "Rb3SCl",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-106274",
"created_at": "2022-09-04T14:38:37.853182Z",
"updated_at": "2022-09-04T14:38:37.853209Z",
"structure_string": "Sr1 Au1 O3\n1.0\n4.099016 0.000000 -0.000000\n-0.000000 4.099016 -0.000000\n0.000000 0.000000 4.099016\nSr Au O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Au\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Au",
"O"
],
"chemical_system": "Au-O-Sr",
"density": 8.018859668647824,
"density_atomic": 0.0725990877771862,
"volume": 68.87138878859602,
"volume_molar": 8.295063952432223,
"formula_full": "Sr1 Au1 O3",
"formula_reduced": "SrAuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2641528759999998,
"spacegroup": 221
},
{
"id": "jvasp-110935",
"created_at": "2022-09-04T14:38:37.848059Z",
"updated_at": "2022-09-04T14:38:37.848088Z",
"structure_string": "Ga1 Ni3 C1\n1.0\n3.776758 -0.000000 0.000000\n0.000000 3.776758 0.000000\n-0.000000 0.000000 3.776758\nGa Ni C\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Ga\n0.500000 0.000000 -0.000000 Ni\n-0.000000 0.500000 -0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ga",
"Ni",
"C"
],
"chemical_system": "C-Ga-Ni",
"density": 7.946903742058372,
"density_atomic": 0.09281379506183478,
"volume": 53.871302177320516,
"volume_molar": 6.488411292726373,
"formula_full": "Ga1 Ni3 C1",
"formula_reduced": "GaNi3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8392779050000003,
"spacegroup": 221
},
{
"id": "jvasp-120085",
"created_at": "2022-09-04T14:38:38.363569Z",
"updated_at": "2022-09-04T14:38:38.363586Z",
"structure_string": "In1 Ge1 Cl3\n1.0\n5.290149 -0.049140 -0.313108\n0.286165 5.281411 -0.339905\n0.576722 0.568866 5.238628\nIn Ge Cl\n1 1 3\ndirect\n0.935141 0.933002 0.922410 In\n0.492531 0.490495 0.480521 Ge\n0.027376 0.520487 0.510716 Cl\n0.522501 0.520546 0.015617 Cl\n0.522446 0.025472 0.510733 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"In",
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge-In",
"density": 3.2882906383356243,
"density_atomic": 0.03369878034744538,
"volume": 148.37332237096933,
"volume_molar": 17.870500646936687,
"formula_full": "In1 Ge1 Cl3",
"formula_reduced": "InGeCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0025519999999999,
"spacegroup": 160
},
{
"id": "jvasp-112901",
"created_at": "2022-09-04T14:38:45.363470Z",
"updated_at": "2022-09-04T14:38:45.363500Z",
"structure_string": "Rb4 Ge4 Cl12\n1.0\n7.166605 -0.000000 0.000000\n0.000000 7.766774 0.000000\n-0.000000 -0.000000 10.670260\nRb Ge Cl\n4 4 12\ndirect\n0.971087 0.422123 0.750917 Rb\n0.471087 0.077877 0.250917 Rb\n0.528914 0.922123 0.750917 Rb\n0.028914 0.577876 0.250917 Rb\n0.486984 0.476025 0.515699 Ge\n0.513017 0.523974 0.015699 Ge\n0.013016 0.976025 0.515699 Ge\n0.986984 0.023974 0.015699 Ge\n0.574446 0.499256 0.239752 Cl\n0.925555 -0.000744 0.239752 Cl\n0.700971 0.181239 0.968036 Cl\n0.425555 0.500743 0.739752 Cl\n0.799030 0.681238 0.968036 Cl\n0.172109 0.287781 0.040794 Cl\n0.299029 0.818761 0.468036 Cl\n0.827892 0.712218 0.540794 Cl\n0.074445 0.000744 0.739752 Cl\n0.327892 0.787781 0.040794 Cl\n0.200971 0.318761 0.468036 Cl\n0.672109 0.212219 0.540794 Cl\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Rb",
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge-Rb",
"density": 2.9576794980702656,
"density_atomic": 0.03367447684643324,
"volume": 593.9216247131802,
"volume_molar": 17.88339812215333,
"formula_full": "Rb4 Ge4 Cl12",
"formula_reduced": "RbGeCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 33
},
{
"id": "jvasp-110552",
"created_at": "2022-09-04T14:38:38.788455Z",
"updated_at": "2022-09-04T14:38:38.788485Z",
"structure_string": "Nd1 Ga3 Pt1\n1.0\n3.958391 -0.023835 -4.713859\n-0.543100 3.921030 -4.713859\n0.020887 0.023835 6.155395\nNd Ga Pt\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.614892 0.614893 0.000000 Ga\n0.385108 0.385109 0.000000 Ga\n0.750000 0.250000 0.500001 Ga\n0.250000 0.750000 0.500000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Ga",
"Pt"
],
"chemical_system": "Ga-Nd-Pt",
"density": 9.452793781669902,
"density_atomic": 0.05189295686208744,
"volume": 96.35218924387326,
"volume_molar": 11.604928923215255,
"formula_full": "Nd1 Ga3 Pt1",
"formula_reduced": "NdGa3Pt",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.483699975,
"spacegroup": 119
},
{
"id": "jvasp-120082",
"created_at": "2022-09-04T14:38:38.249138Z",
"updated_at": "2022-09-04T14:38:38.249160Z",
"structure_string": "In1 Ge1 Cl3\n1.0\n3.853753 -3.660071 -0.024156\n3.853753 3.660071 -0.024156\n-0.335780 0.000000 5.303332\nIn Ge Cl\n1 1 3\ndirect\n0.931029 0.931029 0.053838 In\n0.490549 0.490549 0.495955 Ge\n0.027451 0.521623 0.465515 Cl\n0.521436 0.521436 0.959317 Cl\n0.521623 0.027451 0.465515 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"In",
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge-In",
"density": 3.2624676380818936,
"density_atomic": 0.033434143273301915,
"volume": 149.5477230903846,
"volume_molar": 18.011948775755965,
"formula_full": "In1 Ge1 Cl3",
"formula_reduced": "InGeCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-115218",
"created_at": "2022-09-04T14:38:43.264327Z",
"updated_at": "2022-09-04T14:38:43.264350Z",
"structure_string": "Mg1 Mo1 O3\n1.0\n2.842388 -2.901533 0.221130\n2.842388 2.901533 0.221130\n-0.465146 0.000000 3.832142\nMg Mo O\n1 1 3\ndirect\n0.518987 0.518987 0.788964 Mg\n0.023689 0.023689 0.911087 Mo\n0.523725 0.022521 0.890853 O\n0.022521 0.523725 0.890853 O\n0.024434 0.024434 0.404897 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"O"
],
"chemical_system": "Mg-Mo-O",
"density": 4.378469547763652,
"density_atomic": 0.07836203763099607,
"volume": 63.80640615223426,
"volume_molar": 7.685023184769694,
"formula_full": "Mg1 Mo1 O3",
"formula_reduced": "MgMoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.21716709,
"spacegroup": 99
},
{
"id": "jvasp-114816",
"created_at": "2022-09-04T14:38:42.910353Z",
"updated_at": "2022-09-04T14:38:42.910371Z",
"structure_string": "Zn1 Co1 F3\n1.0\n4.001225 -0.000000 -0.000000\n-0.000000 4.001225 -0.000000\n-0.000000 0.000000 4.001225\nZn Co F\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Zn\n0.000000 0.000000 0.000000 Co\n0.000000 0.499999 0.499999 F\n0.499999 0.000000 0.499999 F\n0.499999 0.499999 0.000000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zn",
"Co",
"F"
],
"chemical_system": "Co-F-Zn",
"density": 4.700646279958751,
"density_atomic": 0.0780532665974436,
"volume": 64.05881800933825,
"volume_molar": 7.71542437942916,
"formula_full": "Zn1 Co1 F3",
"formula_reduced": "ZnCoF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.120221565,
"spacegroup": 221
},
{
"id": "jvasp-110487",
"created_at": "2022-09-04T14:38:37.360861Z",
"updated_at": "2022-09-04T14:38:37.360876Z",
"structure_string": "Tl2 Ni2 Cl6\n1.0\n6.825036 -0.000000 0.000000\n-3.412517 5.910654 -0.000000\n-0.000000 0.000000 5.841697\nTl Ni Cl\n2 2 6\ndirect\n0.333333 0.666667 0.750000 Tl\n0.666667 0.333333 0.250000 Tl\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.161022 0.322044 0.250000 Cl\n0.838977 0.677955 0.750000 Cl\n0.677956 0.838977 0.250000 Cl\n0.322044 0.161022 0.750000 Cl\n0.161022 0.838977 0.250000 Cl\n0.838978 0.161022 0.750000 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tl",
"Ni",
"Cl"
],
"chemical_system": "Cl-Ni-Tl",
"density": 5.206410931307938,
"density_atomic": 0.04243463679007507,
"volume": 235.656547491385,
"volume_molar": 14.191569000087451,
"formula_full": "Tl2 Ni2 Cl6",
"formula_reduced": "TlNiCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 194
}
]
}