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=id&page=4046",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=4044",
"results": [
{
"id": "jvasp-85189",
"created_at": "2022-09-04T14:37:09.610545Z",
"updated_at": "2022-09-04T14:37:09.610568Z",
"structure_string": "La2 Sb2 Pd2\n1.0\n4.646079 0.000000 0.000000\n-2.323040 4.023487 -0.000000\n0.000000 -0.000000 8.205245\nLa Sb Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 La\n0.333336 0.666672 0.750000 Sb\n0.666665 0.333329 0.250000 Sb\n0.333321 0.666643 0.250000 Pd\n0.666680 0.333358 0.750000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Sb",
"Pd"
],
"chemical_system": "La-Pd-Sb",
"density": 7.948140617777086,
"density_atomic": 0.039117447168694544,
"volume": 153.38424243598809,
"volume_molar": 15.39502497192476,
"formula_full": "La2 Sb2 Pd2",
"formula_reduced": "LaSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1457289333333336,
"spacegroup": 194
},
{
"id": "jvasp-85191",
"created_at": "2022-09-04T14:37:09.753677Z",
"updated_at": "2022-09-04T14:37:09.753697Z",
"structure_string": "La2 Sb2 Te2\n1.0\n4.428984 -0.000000 0.000000\n-0.000000 4.428984 -0.000000\n0.000000 -0.000000 9.625435\nLa Sb Te\n2 2 2\ndirect\n0.749999 0.749999 0.722463 La\n0.250000 0.250000 0.277538 La\n0.749999 0.250000 0.000000 Sb\n0.250000 0.749999 0.000000 Sb\n0.749999 0.749999 0.372137 Te\n0.250000 0.250000 0.627863 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Sb",
"Te"
],
"chemical_system": "La-Sb-Te",
"density": 6.8293484731246945,
"density_atomic": 0.03177771473094996,
"volume": 188.8115634116474,
"volume_molar": 18.950830199676773,
"formula_full": "La2 Sb2 Te2",
"formula_reduced": "LaSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8609296222222225,
"spacegroup": 129
},
{
"id": "jvasp-85192",
"created_at": "2022-09-04T14:37:19.549277Z",
"updated_at": "2022-09-04T14:37:19.549301Z",
"structure_string": "La2 S4\n1.0\n4.054591 -0.000000 0.000000\n0.000000 4.054591 0.000000\n-0.000000 -0.000000 8.294634\nLa S\n2 4\ndirect\n0.750000 0.750000 0.724461 La\n0.250000 0.250000 0.275539 La\n0.750000 0.750000 0.364864 S\n0.250000 0.250000 0.635136 S\n0.750000 0.250000 0.000000 S\n0.250000 0.750000 0.000000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"S"
],
"chemical_system": "La-S",
"density": 4.944924631334379,
"density_atomic": 0.04400073374535651,
"volume": 136.36136239735302,
"volume_molar": 13.686455309703847,
"formula_full": "La2 S4",
"formula_reduced": "LaS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0211716666666668,
"spacegroup": 129
},
{
"id": "jvasp-85193",
"created_at": "2022-09-04T14:37:09.953428Z",
"updated_at": "2022-09-04T14:37:09.953449Z",
"structure_string": "La2 Te2 Cl2\n1.0\n4.542119 0.000000 -0.000000\n0.000000 4.542119 0.000000\n-0.000000 -0.000000 8.305856\nLa Te Cl\n2 2 2\ndirect\n0.750000 0.750000 0.759103 La\n0.250000 0.250000 0.240897 La\n0.750000 0.750000 0.361659 Te\n0.250000 0.250000 0.638342 Te\n0.750000 0.250000 0.000000 Cl\n0.250000 0.750000 0.000000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Te",
"Cl"
],
"chemical_system": "Cl-La-Te",
"density": 5.8522772897474935,
"density_atomic": 0.03501465378757882,
"volume": 171.35682781271578,
"volume_molar": 17.19891562125429,
"formula_full": "La2 Te2 Cl2",
"formula_reduced": "LaTeCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1587156113888888,
"spacegroup": 129
},
{
"id": "jvasp-85195",
"created_at": "2022-09-04T14:37:15.949061Z",
"updated_at": "2022-09-04T14:37:15.949079Z",
"structure_string": "La2 Tl2 Zn2\n1.0\n4.819564 0.000000 0.000000\n-2.409782 4.174235 0.000000\n0.000000 0.000000 7.837700\nLa Tl Zn\n2 2 2\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 La\n0.333338 0.666675 0.250000 Tl\n0.666662 0.333326 0.750000 Tl\n0.333334 0.666667 0.750000 Zn\n0.666666 0.333334 0.250000 Zn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Tl",
"Zn"
],
"chemical_system": "La-Tl-Zn",
"density": 8.608115351793986,
"density_atomic": 0.038052041985500565,
"volume": 157.67879164766646,
"volume_molar": 15.826064636149331,
"formula_full": "La2 Tl2 Zn2",
"formula_reduced": "LaTlZn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-85196",
"created_at": "2022-09-04T14:37:16.776622Z",
"updated_at": "2022-09-04T14:37:16.776645Z",
"structure_string": "La2 Zn2 Ga2\n1.0\n4.522842 0.000000 0.000000\n-2.261421 3.916923 -0.000000\n0.000000 0.000000 7.931660\nLa Zn Ga\n2 2 2\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 La\n0.333337 0.666674 0.750000 Zn\n0.666662 0.333325 0.250000 Zn\n0.333338 0.666674 0.250000 Ga\n0.666662 0.333325 0.750000 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Zn",
"Ga"
],
"chemical_system": "Ga-La-Zn",
"density": 6.476919546383505,
"density_atomic": 0.04270027877537631,
"volume": 140.51430510706595,
"volume_molar": 14.103282069138967,
"formula_full": "La2 Zn2 Ga2",
"formula_reduced": "LaZnGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-85198",
"created_at": "2022-09-04T14:37:10.156463Z",
"updated_at": "2022-09-04T14:37:10.156489Z",
"structure_string": "Li3 La1 As2\n1.0\n4.336511 0.000117 0.000050\n-2.168154 3.755353 0.000000\n0.000083 0.000047 7.040939\nLi La As\n3 1 2\ndirect\n-0.000000 0.000000 0.500000 Li\n0.666666 0.333333 0.640330 Li\n0.333335 0.666668 0.359670 Li\n0.000000 0.000000 0.000000 La\n0.666676 0.333339 0.261470 As\n0.333324 0.666662 0.738530 As\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"La",
"As"
],
"chemical_system": "As-La-Li",
"density": 4.48313422541249,
"density_atomic": 0.052326620250627336,
"volume": 114.66439015671124,
"volume_molar": 11.508751628054558,
"formula_full": "Li3 La1 As2",
"formula_reduced": "Li3LaAs2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4104814166666668,
"spacegroup": 164
},
{
"id": "jvasp-85199",
"created_at": "2022-09-04T14:37:18.358569Z",
"updated_at": "2022-09-04T14:37:18.358596Z",
"structure_string": "Np2 Te4\n1.0\n4.454773 0.000000 -0.000000\n-0.000000 4.454773 -0.000000\n-0.000000 -0.000000 8.833901\nNp Te\n2 4\ndirect\n0.750000 0.750000 0.730186 Np\n0.250000 0.250000 0.269814 Np\n0.750000 0.750000 0.364895 Te\n0.250000 0.250000 0.635105 Te\n0.750000 0.250000 0.000000 Te\n0.250000 0.750000 0.000000 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Np",
"Te"
],
"chemical_system": "Np-Te",
"density": 9.324316725067233,
"density_atomic": 0.03422532374761204,
"volume": 175.30878726658153,
"volume_molar": 17.595569889737494,
"formula_full": "Np2 Te4",
"formula_reduced": "NpTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.415168511111111,
"spacegroup": 129
},
{
"id": "jvasp-852",
"created_at": "2022-09-04T14:38:00.115323Z",
"updated_at": "2022-09-04T14:38:00.115350Z",
"structure_string": "Ce1\n1.0\n2.883450 0.000000 1.664760\n0.961150 2.718543 1.664760\n-0.000000 0.000000 3.329520\nCe\n1\ndirect\n0.000000 0.000000 -0.000000 Ce\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ce"
],
"chemical_system": "Ce",
"density": 8.914696626342065,
"density_atomic": 0.0383150803156539,
"volume": 26.09938415270509,
"volume_molar": 15.717416511690338,
"formula_full": "Ce1",
"formula_reduced": "Ce",
"formula_anonymous": "A",
"energy_above_hull": 1.5499999999946112e-05,
"spacegroup": 225
},
{
"id": "jvasp-8520",
"created_at": "2022-09-04T14:37:17.197344Z",
"updated_at": "2022-09-04T14:37:17.197370Z",
"structure_string": "Zn1 In2 S4\n1.0\n1.957728 -3.390883 -0.000000\n1.957728 3.390883 0.000000\n0.000000 0.000000 12.365275\nZn In S\n1 2 4\ndirect\n-0.000000 -0.000000 0.293865 Zn\n0.333334 0.666667 0.605709 In\n0.666667 0.333334 0.930176 In\n0.666667 0.333334 0.250838 S\n0.666667 0.333334 0.730931 S\n-0.000000 -0.000000 0.503097 S\n-0.000000 -0.000000 0.017387 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.2815750740492335,
"density_atomic": 0.04263822408320164,
"volume": 164.17194079989412,
"volume_molar": 14.123807661990703,
"formula_full": "Zn1 In2 S4",
"formula_reduced": "Zn(InS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7694999957142857,
"spacegroup": 156
},
{
"id": "jvasp-85202",
"created_at": "2022-09-04T14:36:52.553166Z",
"updated_at": "2022-09-04T14:36:52.553186Z",
"structure_string": "Re2 N4\n1.0\n3.871349 0.000000 1.742926\n0.000000 2.961799 0.000000\n0.002431 0.000000 5.007688\nRe N\n2 4\ndirect\n0.500000 0.811070 0.750001 Re\n0.500000 0.188930 0.250000 Re\n0.176625 0.302679 0.691629 N\n0.823375 0.302679 0.808372 N\n0.823375 0.697322 0.308372 N\n0.176625 0.697322 0.191629 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 12.39309212574889,
"density_atomic": 0.1045179804426175,
"volume": 57.40639050420729,
"volume_molar": 5.761822735664396,
"formula_full": "Re2 N4",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.166004833333332,
"spacegroup": 13
},
{
"id": "jvasp-85203",
"created_at": "2022-09-04T14:37:14.759230Z",
"updated_at": "2022-09-04T14:37:14.759255Z",
"structure_string": "La2 Se4\n1.0\n4.235091 0.000000 -0.000000\n0.000000 4.235091 0.000000\n-0.000000 0.000000 8.659982\nLa Se\n2 4\ndirect\n0.750000 0.750000 0.724267 La\n0.250000 0.250000 0.275733 La\n0.750000 0.750000 0.365422 Se\n0.250000 0.250000 0.634578 Se\n0.750000 0.250000 0.000000 Se\n0.250000 0.750000 0.000000 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"Se"
],
"chemical_system": "La-Se",
"density": 6.346551008635557,
"density_atomic": 0.03862858217092818,
"volume": 155.32540059198942,
"volume_molar": 15.589857099472463,
"formula_full": "La2 Se4",
"formula_reduced": "LaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7671005777777775,
"spacegroup": 129
}
]
}