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_reduced&page=107",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=105",
"results": [
{
"id": "jvasp-5101",
"created_at": "2022-09-04T14:37:12.871718Z",
"updated_at": "2022-09-04T14:37:12.871741Z",
"structure_string": "Zn2 In4 S8\n1.0\n1.963964 -3.401683 0.000000\n1.963964 3.401683 -0.000000\n-0.000000 -0.000000 24.896043\nZn In S\n2 4 8\ndirect\n0.333332 0.666666 0.043619 Zn\n0.666666 0.333332 0.956381 Zn\n0.333332 0.666666 0.606269 In\n0.666666 0.333332 0.393730 In\n-0.000000 0.000000 0.231541 In\n-0.000000 0.000000 0.768459 In\n0.666666 0.333332 0.062191 S\n0.333332 0.666666 0.703147 S\n0.666666 0.333332 0.560444 S\n0.333332 0.666666 0.439556 S\n0.666666 0.333332 0.296853 S\n0.666666 0.333332 0.816971 S\n0.333332 0.666666 0.937809 S\n0.333332 0.666666 0.183029 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.22614903095331,
"density_atomic": 0.042086261778513115,
"volume": 332.6501192640401,
"volume_molar": 14.309041728848836,
"formula_full": "Zn2 In4 S8",
"formula_reduced": "Zn(InS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7704328528571429,
"spacegroup": 164
},
{
"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-29484",
"created_at": "2022-09-04T14:38:13.285276Z",
"updated_at": "2022-09-04T14:38:13.285295Z",
"structure_string": "Zn2 In4 S8\n1.0\n3.914873 -0.000000 -0.000000\n-1.957436 3.390380 -0.000000\n-0.000000 -0.000000 24.756149\nZn In S\n2 4 8\ndirect\n0.000000 0.000000 0.912996 Zn\n0.000000 0.000000 0.412996 Zn\n0.666666 0.333333 0.594368 In\n0.333332 0.666667 0.094368 In\n0.333332 0.666667 0.756440 In\n0.666666 0.333333 0.256440 In\n0.333332 0.666667 0.934373 S\n0.666666 0.333333 0.434373 S\n0.666666 0.333333 0.693940 S\n0.000000 0.000000 0.807581 S\n0.000000 0.000000 0.050802 S\n0.333332 0.666667 0.193940 S\n0.000000 0.000000 0.307581 S\n0.000000 0.000000 0.550802 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.27841933381215,
"density_atomic": 0.04260679752707451,
"volume": 328.58606636895655,
"volume_molar": 14.134225310346848,
"formula_full": "Zn2 In4 S8",
"formula_reduced": "Zn(InS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7696842814285715,
"spacegroup": 186
},
{
"id": "jvasp-12403",
"created_at": "2022-09-04T14:36:42.310747Z",
"updated_at": "2022-09-04T14:36:42.310761Z",
"structure_string": "Zn2 In4 S8\n1.0\n6.564241 0.000000 3.789866\n2.188080 6.188825 3.789866\n0.000000 0.000000 7.579732\nZn In S\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.875000 0.875001 0.875001 Zn\n0.500000 0.500000 0.000000 In\n0.500000 0.500000 0.500000 In\n-0.000000 0.500000 0.500000 In\n0.500000 -0.000000 0.500000 In\n0.745934 0.745935 0.745935 S\n0.254065 0.254066 0.737805 S\n0.254065 0.737806 0.254066 S\n0.737805 0.254066 0.254066 S\n0.745934 0.262195 0.745935 S\n0.262195 0.745935 0.745935 S\n0.254065 0.254066 0.254065 S\n0.745934 0.745935 0.262196 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.56547449846844,
"density_atomic": 0.04546544702478843,
"volume": 307.92614867213325,
"volume_molar": 13.245532935630525,
"formula_full": "Zn2 In4 S8",
"formula_reduced": "Zn(InS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7616857100000001,
"spacegroup": 227
},
{
"id": "jvasp-115152",
"created_at": "2022-09-04T14:38:43.401791Z",
"updated_at": "2022-09-04T14:38:43.401812Z",
"structure_string": "Zn1 In1 S1\n1.0\n5.834773 1.487541 0.000000\n-1.895882 3.079637 0.000000\n0.000000 0.000000 3.588705\nZn In S\n1 1 1\ndirect\n0.708848 0.688235 0.000000 Zn\n0.323994 -0.004498 0.000000 In\n-0.032842 0.316264 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.72506189417879,
"density_atomic": 0.04021110711137066,
"volume": 74.60625223998565,
"volume_molar": 14.976311752175299,
"formula_full": "Zn1 In1 S1",
"formula_reduced": "ZnInS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-115151",
"created_at": "2022-09-04T14:38:44.827962Z",
"updated_at": "2022-09-04T14:38:44.827986Z",
"structure_string": "Zn1 In1 S1\n1.0\n2.890138 -0.000000 0.000000\n0.000000 2.890138 0.000000\n0.000000 0.000000 8.064415\nZn In S\n1 1 1\ndirect\n0.000000 -0.000000 0.689627 Zn\n0.000000 -0.000000 0.334447 In\n0.000000 0.000000 -0.012847 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 5.233264637696217,
"density_atomic": 0.04453600177127931,
"volume": 67.36123317505931,
"volume_molar": 13.521960931579631,
"formula_full": "Zn1 In1 S1",
"formula_reduced": "ZnInS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1088,
"spacegroup": 99
},
{
"id": "jvasp-101041",
"created_at": "2022-09-04T14:36:34.441927Z",
"updated_at": "2022-09-04T14:36:34.441948Z",
"structure_string": "Zn1 In1 Rh2\n1.0\n3.835895 -0.000000 2.214655\n1.278632 3.616516 2.214655\n-0.000000 -0.000000 4.429310\nZn In Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.499999 0.500001 0.499999 In\n0.250000 0.250000 0.250000 Rh\n0.749999 0.750001 0.749999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"In",
"Rh"
],
"chemical_system": "In-Rh-Zn",
"density": 10.432441930083062,
"density_atomic": 0.06509787512648751,
"volume": 61.44593801606974,
"volume_molar": 9.250902196575177,
"formula_full": "Zn1 In1 Rh2",
"formula_reduced": "ZnInRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8264940925000002,
"spacegroup": 225
},
{
"id": "jvasp-81787",
"created_at": "2022-09-04T14:37:19.575227Z",
"updated_at": "2022-09-04T14:37:19.575252Z",
"structure_string": "Zn1 In1 Rh2\n1.0\n-8.932874 -0.000000 -5.157397\n-5.776932 -0.471184 -0.308854\n-4.681151 2.628155 -2.206803\nZn In Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 -0.000001 -0.000000 In\n0.762411 -0.000001 -0.000000 Rh\n0.237590 -0.000000 -0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"In",
"Rh"
],
"chemical_system": "In-Rh-Zn",
"density": 8.764535975871278,
"density_atomic": 0.054690231905688946,
"volume": 73.13920348514586,
"volume_molar": 11.011364461545774,
"formula_full": "Zn1 In1 Rh2",
"formula_reduced": "ZnInRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0336340925,
"spacegroup": 139
},
{
"id": "jvasp-101625",
"created_at": "2022-09-04T14:37:13.209388Z",
"updated_at": "2022-09-04T14:37:13.209418Z",
"structure_string": "Zn1 In1 Pd2\n1.0\n3.908055 0.000000 2.256317\n1.302685 3.684550 2.256317\n0.000000 0.000000 4.512634\nZn In Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500001 0.500000 0.500000 In\n0.250001 0.250000 0.250000 Pd\n0.750002 0.750000 0.750000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"In",
"Pd"
],
"chemical_system": "In-Pd-Zn",
"density": 10.044780452043645,
"density_atomic": 0.061558036473586125,
"volume": 64.97933054957586,
"volume_molar": 9.78286687650285,
"formula_full": "Zn1 In1 Pd2",
"formula_reduced": "ZnInPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1931029425,
"spacegroup": 225
},
{
"id": "jvasp-100631",
"created_at": "2022-09-04T14:36:39.051869Z",
"updated_at": "2022-09-04T14:36:39.051881Z",
"structure_string": "Zn1 In1 Ga1 O4\n1.0\n3.290529 0.003233 8.283759\n1.587662 2.882173 8.283759\n0.005466 0.003233 8.913373\nZn In Ga O\n1 1 1 4\ndirect\n0.219054 0.219053 0.219054 Zn\n0.003131 0.003131 0.003131 In\n0.787006 0.787001 0.787004 Ga\n0.295275 0.295273 0.295274 O\n0.711239 0.711235 0.711238 O\n0.120831 0.120830 0.120831 O\n0.863473 0.863468 0.863471 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Zn",
"In",
"Ga",
"O"
],
"chemical_system": "Ga-In-O-Zn",
"density": 6.18328082640887,
"density_atomic": 0.08302535600105897,
"volume": 84.31159271284204,
"volume_molar": 7.253375414521786,
"formula_full": "Zn1 In1 Ga1 O4",
"formula_reduced": "ZnInGaO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 0.9064052421428574,
"spacegroup": 160
},
{
"id": "jvasp-110950",
"created_at": "2022-09-04T14:38:37.388250Z",
"updated_at": "2022-09-04T14:38:37.388264Z",
"structure_string": "Zn1 In3 As1 Se4\n1.0\n5.357339 -0.008737 2.391064\n2.645693 6.561758 1.225675\n-0.006884 -0.007961 7.218725\nZn In As Se\n1 3 1 4\ndirect\n0.978844 0.009681 0.002028 Zn\n0.401141 0.392016 0.804956 In\n0.613808 0.598803 0.194922 In\n0.807308 0.802148 0.597876 In\n0.421076 0.719609 0.904750 As\n0.622309 0.930838 0.300695 Se\n0.891923 0.108494 0.680971 Se\n0.062131 0.273176 0.126516 Se\n0.251464 0.465234 0.487283 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Zn",
"In",
"As",
"Se"
],
"chemical_system": "As-In-Se-Zn",
"density": 5.233287963215026,
"density_atomic": 0.0354273864264065,
"volume": 254.04075512868408,
"volume_molar": 16.998546512906973,
"formula_full": "Zn1 In3 As1 Se4",
"formula_reduced": "ZnIn3AsSe4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.577849502962963,
"spacegroup": 1
},
{
"id": "jvasp-78991",
"created_at": "2022-09-04T14:37:12.056142Z",
"updated_at": "2022-09-04T14:37:12.056171Z",
"structure_string": "Zn1 In3\n1.0\n-2.317403 2.317403 4.632775\n2.317403 -2.317403 4.632775\n2.317403 2.317403 -4.632775\nZn In\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.749999 0.250000 0.499999 In\n0.250000 0.749999 0.499999 In\n0.500000 0.500000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"In"
],
"chemical_system": "In-Zn",
"density": 6.838856368630771,
"density_atomic": 0.040193484850839865,
"volume": 99.51861638382962,
"volume_molar": 14.982877902596606,
"formula_full": "Zn1 In3",
"formula_reduced": "ZnIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
}
]
}