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=nelements&page=413",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=411",
"results": [
{
"id": "jvasp-18026",
"created_at": "2022-09-04T14:38:15.755032Z",
"updated_at": "2022-09-04T14:38:15.755046Z",
"structure_string": "Os2 N4\n1.0\n2.712394 0.000000 0.000000\n0.000000 4.152428 0.000000\n0.000000 0.000000 4.962892\nOs N\n2 4\ndirect\n0.499999 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Os\n0.499999 0.373804 0.905015 N\n0.499999 0.626196 0.094984 N\n0.000000 0.126196 0.405015 N\n0.000000 0.873805 0.594984 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Os",
"N"
],
"chemical_system": "N-Os",
"density": 12.966731012388587,
"density_atomic": 0.10733998743693521,
"volume": 55.89715578758701,
"volume_molar": 5.61034233727496,
"formula_full": "Os2 N4",
"formula_reduced": "OsN2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.9479405,
"spacegroup": 58
},
{
"id": "jvasp-11399",
"created_at": "2022-09-04T14:38:15.715045Z",
"updated_at": "2022-09-04T14:38:15.715064Z",
"structure_string": "Sc8 C6\n1.0\n5.874073 -0.000000 -2.076799\n-2.937037 5.087097 -2.076799\n0.000000 0.000000 6.230396\nSc C\n8 6\ndirect\n0.399478 0.500000 -0.000000 Sc\n0.600521 0.600522 0.600521 Sc\n0.500000 0.000000 0.399479 Sc\n-0.000000 0.399479 0.500000 Sc\n0.500000 0.000000 0.899479 Sc\n-0.000000 0.899479 0.500000 Sc\n0.899478 0.500000 -0.000000 Sc\n0.100521 0.100521 0.100521 Sc\n0.749999 0.875001 0.125000 C\n0.625000 0.375000 0.250000 C\n0.874999 0.125000 0.750000 C\n0.125000 0.750000 0.875000 C\n0.375000 0.250000 0.625000 C\n0.250000 0.625000 0.375000 C\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Sc",
"C"
],
"chemical_system": "C-Sc",
"density": 3.850505090290692,
"density_atomic": 0.07519743491467414,
"volume": 186.1765632815225,
"volume_molar": 8.008439073531257,
"formula_full": "Sc8 C6",
"formula_reduced": "Sc4C3",
"formula_anonymous": "A3B4",
"energy_above_hull": 4.556664428571429,
"spacegroup": 220
},
{
"id": "jvasp-18363",
"created_at": "2022-09-04T14:38:09.214686Z",
"updated_at": "2022-09-04T14:38:09.214710Z",
"structure_string": "Cu2 I2\n1.0\n4.138317 -0.018946 6.323775\n1.871143 3.691186 6.323775\n-0.031004 -0.018946 7.557436\nCu I\n2 2\ndirect\n0.117085 0.117085 0.117085 Cu\n0.882916 0.882914 0.882914 Cu\n0.000000 0.000000 0.000000 I\n0.500001 0.499999 0.499999 I\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 5.4194674306571455,
"density_atomic": 0.034273263513533415,
"volume": 116.70904926869682,
"volume_molar": 17.570958066546684,
"formula_full": "Cu2 I2",
"formula_reduced": "CuI",
"formula_anonymous": "AB",
"energy_above_hull": 0.12784,
"spacegroup": 166
},
{
"id": "jvasp-109553",
"created_at": "2022-09-04T14:38:17.151657Z",
"updated_at": "2022-09-04T14:38:17.151681Z",
"structure_string": "Li1 Cu3\n1.0\n3.616733 0.000000 0.000000\n0.000000 3.616733 0.000000\n0.000000 0.000000 3.616733\nLi Cu\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Cu"
],
"chemical_system": "Cu-Li",
"density": 6.934905287074209,
"density_atomic": 0.08454942237881857,
"volume": 47.30960765264891,
"volume_molar": 7.122627914615622,
"formula_full": "Li1 Cu3",
"formula_reduced": "LiCu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-37481",
"created_at": "2022-09-04T14:38:09.216935Z",
"updated_at": "2022-09-04T14:38:09.216964Z",
"structure_string": "Yb3 Ta1\n1.0\n-2.426947 2.426947 4.622187\n2.426947 -2.426947 4.622187\n2.426947 2.426947 -4.622187\nYb Ta\n3 1\ndirect\n0.750003 0.250000 0.500003 Yb\n0.250000 0.750003 0.500003 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.000000 0.000000 Ta\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Ta"
],
"chemical_system": "Ta-Yb",
"density": 10.674834781116514,
"density_atomic": 0.03673092824304014,
"volume": 108.90005211773894,
"volume_molar": 16.395286065609,
"formula_full": "Yb3 Ta1",
"formula_reduced": "Yb3Ta",
"formula_anonymous": "AB3",
"energy_above_hull": 1.232600325,
"spacegroup": 139
},
{
"id": "jvasp-54",
"created_at": "2022-09-04T14:38:09.223627Z",
"updated_at": "2022-09-04T14:38:09.223644Z",
"structure_string": "Mo2 S4\n1.0\n1.595799 -2.764004 0.000000\n1.595799 2.764004 0.000000\n0.000000 0.000000 12.478901\nMo S\n2 4\ndirect\n0.666667 0.333334 0.250000 Mo\n0.333334 0.666667 0.750000 Mo\n0.333334 0.666667 0.124452 S\n0.666667 0.333334 0.624452 S\n0.333334 0.666667 0.375548 S\n0.666667 0.333334 0.875548 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mo",
"S"
],
"chemical_system": "Mo-S",
"density": 4.829096091969125,
"density_atomic": 0.05450396030384316,
"volume": 110.08374376011957,
"volume_molar": 11.04899667185353,
"formula_full": "Mo2 S4",
"formula_reduced": "MoS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5746252999999992,
"spacegroup": 194
},
{
"id": "jvasp-109268",
"created_at": "2022-09-04T14:38:17.017156Z",
"updated_at": "2022-09-04T14:38:17.017175Z",
"structure_string": "Co1 H3\n1.0\n2.615106 -0.000000 0.000000\n0.000000 2.615106 0.000000\n0.000000 0.000000 2.615106\nCo H\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n-0.000000 0.500001 0.500001 H\n0.500001 0.000000 0.500001 H\n0.500001 0.500001 -0.000000 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"H"
],
"chemical_system": "Co-H",
"density": 5.75269954377215,
"density_atomic": 0.2236619463643027,
"volume": 17.88413301869761,
"volume_molar": 2.692519160229018,
"formula_full": "Co1 H3",
"formula_reduced": "CoH3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.823290225,
"spacegroup": 221
},
{
"id": "jvasp-37142",
"created_at": "2022-09-04T14:38:04.434564Z",
"updated_at": "2022-09-04T14:38:04.434600Z",
"structure_string": "Nb2 C2\n1.0\n1.581854 -2.739852 0.000000\n1.581854 2.739852 0.000000\n-0.000000 0.000000 5.593568\nNb C\n2 2\ndirect\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.333332 0.666666 0.250000 C\n0.666666 0.333332 0.750000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"C"
],
"chemical_system": "C-Nb",
"density": 7.186424535366075,
"density_atomic": 0.08249878881121728,
"volume": 48.485560305051706,
"volume_molar": 7.2996717246122484,
"formula_full": "Nb2 C2",
"formula_reduced": "NbC",
"formula_anonymous": "AB",
"energy_above_hull": 3.7511047,
"spacegroup": 194
},
{
"id": "jvasp-38209",
"created_at": "2022-09-04T14:38:05.563985Z",
"updated_at": "2022-09-04T14:38:05.564012Z",
"structure_string": "K1 Pr3\n1.0\n5.342147 -0.000000 0.000000\n-0.000000 5.342147 -0.000000\n0.000000 -0.000000 5.342147\nK Pr\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.500000 0.500000 Pr\n0.500000 0.000000 0.500000 Pr\n0.500000 0.500000 0.000000 Pr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Pr"
],
"chemical_system": "K-Pr",
"density": 5.030087118497261,
"density_atomic": 0.026236898083941817,
"volume": 152.457046835433,
"volume_molar": 22.952944897422253,
"formula_full": "K1 Pr3",
"formula_reduced": "KPr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.184289066666667,
"spacegroup": 221
},
{
"id": "jvasp-37145",
"created_at": "2022-09-04T14:38:09.251976Z",
"updated_at": "2022-09-04T14:38:09.252004Z",
"structure_string": "Nb1 Cr3\n1.0\n2.975298 2.975298 0.000000\n2.975298 0.000000 -2.975298\n0.000000 2.975298 -2.975298\nNb Cr\n1 3\ndirect\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250000 Cr\n0.750001 0.750001 0.750001 Cr\n0.500000 0.500000 0.500000 Cr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Cr"
],
"chemical_system": "Cr-Nb",
"density": 7.84590968658569,
"density_atomic": 0.07593440332142867,
"volume": 52.67704525270433,
"volume_molar": 7.930714533316882,
"formula_full": "Nb1 Cr3",
"formula_reduced": "NbCr3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.9797429,
"spacegroup": 225
},
{
"id": "jvasp-20617",
"created_at": "2022-09-04T14:38:09.252344Z",
"updated_at": "2022-09-04T14:38:09.252372Z",
"structure_string": "Lu1 Mg1\n1.0\n3.699120 -0.000000 -0.000000\n-0.000000 3.699120 -0.000000\n0.000000 -0.000000 3.699120\nLu Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Lu",
"Mg"
],
"chemical_system": "Lu-Mg",
"density": 6.537325609488343,
"density_atomic": 0.0395125206028911,
"volume": 50.61686699515853,
"volume_molar": 15.241094893752146,
"formula_full": "Lu1 Mg1",
"formula_reduced": "LuMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.3541235833333332,
"spacegroup": 221
},
{
"id": "jvasp-110007",
"created_at": "2022-09-04T14:38:04.825784Z",
"updated_at": "2022-09-04T14:38:04.825811Z",
"structure_string": "Mo3 Pd1\n1.0\n3.957152 -0.000000 0.000000\n0.000000 3.957152 0.000000\n-0.000000 0.000000 3.957152\nMo Pd\n3 1\ndirect\n-0.000000 0.500000 0.500000 Mo\n0.500000 0.500000 -0.000000 Mo\n0.500000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mo",
"Pd"
],
"chemical_system": "Mo-Pd",
"density": 10.56480745030912,
"density_atomic": 0.06455231086652281,
"volume": 61.965248746415085,
"volume_molar": 9.32908625448313,
"formula_full": "Mo3 Pd1",
"formula_reduced": "Mo3Pd",
"formula_anonymous": "AB3",
"energy_above_hull": 4.9217733500000005,
"spacegroup": 221
}
]
}