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=-volume&page=3573",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=3571",
"results": [
{
"id": "jvasp-114396",
"created_at": "2022-09-04T14:38:40.601924Z",
"updated_at": "2022-09-04T14:38:40.601958Z",
"structure_string": "Sr1 Ta1 O1\n1.0\n3.116235 0.000000 0.000000\n0.000000 3.116235 0.000000\n-0.000000 0.000000 7.526931\nSr Ta O\n1 1 1\ndirect\n0.000000 0.000000 0.540744 Sr\n0.000000 0.000000 -0.000259 Ta\n0.000000 0.000000 0.237206 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"O"
],
"chemical_system": "O-Sr-Ta",
"density": 6.464809371098148,
"density_atomic": 0.041043361028127535,
"volume": 73.09342911619889,
"volume_molar": 14.672630625627736,
"formula_full": "Sr1 Ta1 O1",
"formula_reduced": "SrTaO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.36380967,
"spacegroup": 99
},
{
"id": "jvasp-41325",
"created_at": "2022-09-04T14:37:43.810917Z",
"updated_at": "2022-09-04T14:37:43.810940Z",
"structure_string": "Na1 Tl1 Pd2\n1.0\n0.000000 3.318497 3.318497\n3.318497 0.000000 3.318497\n3.318497 3.318497 0.000000\nNa Tl Pd\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Na\n0.750001 0.750001 0.750001 Tl\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Tl",
"Pd"
],
"chemical_system": "Na-Pd-Tl",
"density": 10.001329731779496,
"density_atomic": 0.05472751233967014,
"volume": 73.0893809894687,
"volume_molar": 11.003863509496213,
"formula_full": "Na1 Tl1 Pd2",
"formula_reduced": "NaTlPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5042407625,
"spacegroup": 225
},
{
"id": "jvasp-80918",
"created_at": "2022-09-04T14:36:47.681062Z",
"updated_at": "2022-09-04T14:36:47.681092Z",
"structure_string": "Y1 Zn2 Au1\n1.0\n-10.981434 3.187810 -1.135227\n-7.919139 0.894348 1.582164\n-6.564029 4.727541 -0.763767\nY Zn Au\n1 2 1\ndirect\n-0.000000 0.000000 0.000000 Y\n0.749664 0.000190 0.000196 Zn\n0.250336 -0.000192 -0.000196 Zn\n0.500000 -0.000001 -0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Zn",
"Au"
],
"chemical_system": "Au-Y-Zn",
"density": 9.467077627448601,
"density_atomic": 0.05472847128557997,
"volume": 73.0881003258341,
"volume_molar": 11.003670701079372,
"formula_full": "Y1 Zn2 Au1",
"formula_reduced": "YZn2Au",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-1519",
"created_at": "2022-09-04T14:36:57.263498Z",
"updated_at": "2022-09-04T14:36:57.263514Z",
"structure_string": "Sc1 Cu1 S2\n1.0\n1.870034 -3.238995 0.000000\n1.870034 3.238995 0.000000\n0.000000 0.000000 6.033274\nSc Cu S\n1 1 2\ndirect\n0.000000 0.000000 0.997891 Sc\n0.333332 0.666666 0.596326 Cu\n0.666666 0.333332 0.742265 S\n0.333332 0.666666 0.220716 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Cu",
"S"
],
"chemical_system": "Cu-S-Sc",
"density": 3.9221784840434966,
"density_atomic": 0.05472895631235525,
"volume": 73.08745259402994,
"volume_molar": 11.003573182776885,
"formula_full": "Sc1 Cu1 S2",
"formula_reduced": "ScCuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.139778925,
"spacegroup": 156
},
{
"id": "jvasp-71832",
"created_at": "2022-09-04T14:35:41.078183Z",
"updated_at": "2022-09-04T14:35:41.078203Z",
"structure_string": "Be2 In1 Pt2\n1.0\n-1.719802 1.719802 6.177501\n1.719802 -1.719802 6.177501\n1.719802 1.719802 -6.177501\nBe In Pt\n2 1 2\ndirect\n0.749999 0.250000 0.499999 Be\n0.250000 0.749999 0.499999 Be\n0.000000 0.000000 0.000000 In\n0.622619 0.622619 0.000000 Pt\n0.377380 0.377380 0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Be",
"In",
"Pt"
],
"chemical_system": "Be-In-Pt",
"density": 11.88309796212127,
"density_atomic": 0.06841326056159532,
"volume": 73.08524632440653,
"volume_molar": 8.802592816896976,
"formula_full": "Be2 In1 Pt2",
"formula_reduced": "Be2InPt2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.691010994,
"spacegroup": 139
},
{
"id": "jvasp-41449",
"created_at": "2022-09-04T14:37:38.140806Z",
"updated_at": "2022-09-04T14:37:38.140833Z",
"structure_string": "Tm1 Zr1 Os2\n1.0\n0.000000 3.318323 3.318323\n3.318323 0.000000 3.318323\n3.318323 3.318323 0.000000\nTm Zr Os\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Tm\n0.750000 0.750000 0.750000 Zr\n0.000000 0.000000 0.000000 Os\n0.499999 0.499999 0.499999 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Zr",
"Os"
],
"chemical_system": "Os-Tm-Zr",
"density": 14.556682503372604,
"density_atomic": 0.0547361218871585,
"volume": 73.07788462336111,
"volume_molar": 11.002132691123006,
"formula_full": "Tm1 Zr1 Os2",
"formula_reduced": "TmZrOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.2722321875,
"spacegroup": 225
},
{
"id": "jvasp-108790",
"created_at": "2022-09-04T14:38:20.126058Z",
"updated_at": "2022-09-04T14:38:20.126089Z",
"structure_string": "Cu1 Ni3 O4\n1.0\n2.918379 -0.000000 0.443780\n-1.492931 2.546573 0.000000\n-0.002209 -0.001295 9.832300\nCu Ni O\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Cu\n0.498662 0.249330 0.252007 Ni\n-0.000001 0.499999 0.500000 Ni\n0.501337 0.750667 0.747993 Ni\n0.250605 0.125301 0.624092 O\n0.757586 0.378792 0.863618 O\n0.242413 0.621205 0.136382 O\n0.749394 0.874696 0.375908 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"Ni",
"O"
],
"chemical_system": "Cu-Ni-O",
"density": 6.899411209802421,
"density_atomic": 0.10947554303953934,
"volume": 73.07568227463038,
"volume_molar": 5.500900559885764,
"formula_full": "Cu1 Ni3 O4",
"formula_reduced": "CuNi3O4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.70451020625,
"spacegroup": 166
},
{
"id": "jvasp-18737",
"created_at": "2022-09-04T14:37:03.617349Z",
"updated_at": "2022-09-04T14:37:03.617375Z",
"structure_string": "Li3 Pb1\n1.0\n-2.345689 2.345689 3.320252\n2.345689 -2.345689 3.320252\n2.345689 2.345689 -3.320252\nLi Pb\n3 1\ndirect\n0.750002 0.250001 0.500001 Li\n0.250001 0.750002 0.500001 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Pb"
],
"chemical_system": "Li-Pb",
"density": 5.181504168288992,
"density_atomic": 0.05473789479262423,
"volume": 73.07551770403468,
"volume_molar": 11.001776343089222,
"formula_full": "Li3 Pb1",
"formula_reduced": "Li3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.493407705,
"spacegroup": 225
},
{
"id": "jvasp-79428",
"created_at": "2022-09-04T14:37:13.847369Z",
"updated_at": "2022-09-04T14:37:13.847399Z",
"structure_string": "Li3 Pb1\n1.0\n-2.345689 2.345689 3.320252\n2.345689 -2.345689 3.320252\n2.345689 2.345689 -3.320252\nLi Pb\n3 1\ndirect\n0.750002 0.250001 0.500001 Li\n0.250001 0.750002 0.500001 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Pb"
],
"chemical_system": "Li-Pb",
"density": 5.181504168288992,
"density_atomic": 0.05473789479262423,
"volume": 73.07551770403468,
"volume_molar": 11.001776343089222,
"formula_full": "Li3 Pb1",
"formula_reduced": "Li3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.493407705,
"spacegroup": 225
},
{
"id": "jvasp-114411",
"created_at": "2022-09-04T14:38:40.694468Z",
"updated_at": "2022-09-04T14:38:40.694497Z",
"structure_string": "Zr1 Zn1 O4\n1.0\n3.350503 -3.367970 0.000000\n3.350503 3.367970 0.000000\n0.000000 0.000000 3.237646\nZr Zn O\n1 1 4\ndirect\n0.000000 0.000000 0.500001 Zr\n0.500000 0.500000 0.000000 Zn\n0.197966 0.197966 0.000000 O\n0.310423 0.689578 0.500001 O\n0.689578 0.310423 0.500001 O\n0.802034 0.802034 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Zn",
"O"
],
"chemical_system": "O-Zn-Zr",
"density": 5.013918386498288,
"density_atomic": 0.08211333049834253,
"volume": 73.06974353112021,
"volume_molar": 7.333938014025089,
"formula_full": "Zr1 Zn1 O4",
"formula_reduced": "ZrZnO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.964501483333334,
"spacegroup": 65
},
{
"id": "jvasp-71969",
"created_at": "2022-09-04T14:35:45.832143Z",
"updated_at": "2022-09-04T14:35:45.832161Z",
"structure_string": "Na2 Ta1 Be1\n1.0\n-1.838226 1.838226 5.405770\n1.838226 -1.838226 5.405770\n1.838226 1.838226 -5.405770\nNa Ta Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Na\n0.250000 0.750001 0.500001 Ta\n0.750001 0.250000 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ta",
"Be"
],
"chemical_system": "Be-Na-Ta",
"density": 5.362095853135898,
"density_atomic": 0.054745021065921655,
"volume": 73.06600531185052,
"volume_molar": 11.000344218971787,
"formula_full": "Na2 Ta1 Be1",
"formula_reduced": "Na2TaBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.011195825,
"spacegroup": 139
},
{
"id": "jvasp-113555",
"created_at": "2022-09-04T14:38:47.607549Z",
"updated_at": "2022-09-04T14:38:47.607578Z",
"structure_string": "Li2 Ca2 N2\n1.0\n3.562614 -0.000000 -0.000000\n-1.781307 3.085315 0.000000\n0.000000 0.000000 6.647229\nLi Ca N\n2 2 2\ndirect\n0.666665 0.333332 0.750000 Li\n0.333331 0.666665 0.250000 Li\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.666665 0.333332 0.250000 N\n0.333331 0.666665 0.750000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Ca",
"N"
],
"chemical_system": "Ca-Li-N",
"density": 2.7738498026795853,
"density_atomic": 0.08211874979528662,
"volume": 73.06492140902495,
"volume_molar": 7.33345402239143,
"formula_full": "Li2 Ca2 N2",
"formula_reduced": "LiCaN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3315878899999998,
"spacegroup": 194
}
]
}