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=-chemical_system&page=1531",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1529",
"results": [
{
"id": "jvasp-106534",
"created_at": "2022-09-04T14:36:58.094920Z",
"updated_at": "2022-09-04T14:36:58.094949Z",
"structure_string": "K3 Ga1\n1.0\n5.625488 -0.000000 0.000000\n0.000000 5.625488 0.000000\n-0.000000 -0.000000 5.625488\nK Ga\n3 1\ndirect\n0.500000 0.000000 0.500000 K\n-0.000000 0.500000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 1.7444224438234008,
"density_atomic": 0.02246877439055421,
"volume": 178.0248415187962,
"volume_molar": 26.802266360072075,
"formula_full": "K3 Ga1",
"formula_reduced": "K3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.00256,
"spacegroup": 221
},
{
"id": "jvasp-105181",
"created_at": "2022-09-04T14:36:57.419935Z",
"updated_at": "2022-09-04T14:36:57.419944Z",
"structure_string": "K3 Ga1\n1.0\n5.409499 -0.000000 3.123176\n1.803166 5.100125 3.123176\n-0.000000 -0.000000 6.246352\nK Ga\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750001 0.749999 0.750001 K\n0.500001 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 1.8020546351620208,
"density_atomic": 0.023211097277654025,
"volume": 172.331361682367,
"volume_molar": 25.945092935342117,
"formula_full": "K3 Ga1",
"formula_reduced": "K3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.000975,
"spacegroup": 225
},
{
"id": "jvasp-105182",
"created_at": "2022-09-04T14:36:57.438323Z",
"updated_at": "2022-09-04T14:36:57.438344Z",
"structure_string": "K3 Ga1\n1.0\n5.105092 -0.033583 -4.417577\n-1.088140 4.987890 -4.417577\n0.027229 0.033583 6.751016\nK Ga\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 1.7932080918769926,
"density_atomic": 0.023097150689824125,
"volume": 173.18153454149967,
"volume_molar": 26.07308945104283,
"formula_full": "K3 Ga1",
"formula_reduced": "K3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-86679",
"created_at": "2022-09-04T14:35:55.787542Z",
"updated_at": "2022-09-04T14:35:55.787562Z",
"structure_string": "K4 Ga6\n1.0\n5.749277 -0.000000 -2.200651\n-0.842343 5.687236 -2.200651\n-0.049209 -0.057034 8.481860\nK Ga\n4 6\ndirect\n0.390427 0.390427 0.780854 K\n0.250001 0.750001 0.500000 K\n0.609574 0.609574 0.219147 K\n0.750000 0.250001 0.500000 K\n0.000000 0.294801 0.000000 Ga\n0.143250 0.143250 0.286499 Ga\n0.294801 0.000000 0.000000 Ga\n0.000000 0.705199 0.000000 Ga\n0.856751 0.856751 0.713501 Ga\n0.705199 0.000000 0.000000 Ga\n",
"nsites": 10,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 3.45918815290714,
"density_atomic": 0.036246018972573964,
"volume": 275.89236786436146,
"volume_molar": 16.61462673888885,
"formula_full": "K4 Ga6",
"formula_reduced": "K2Ga3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-122674",
"created_at": "2022-09-04T14:38:52.155394Z",
"updated_at": "2022-09-04T14:38:52.155414Z",
"structure_string": "K1 Ga3\n1.0\n5.663885 -0.654142 -0.772078\n-3.313961 4.639521 0.772078\n-0.962129 0.567306 4.445723\nK Ga\n1 3\ndirect\n0.063445 0.936556 0.929587 K\n0.427705 0.572296 0.312361 Ga\n0.812443 0.187559 0.182495 Ga\n0.696410 0.303592 0.575555 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 3.9948899930469643,
"density_atomic": 0.03876110928367627,
"volume": 103.19622100403993,
"volume_molar": 15.536554219659925,
"formula_full": "K1 Ga3",
"formula_reduced": "KGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0234774999999999,
"spacegroup": 8
},
{
"id": "jvasp-116111",
"created_at": "2022-09-04T14:38:49.012757Z",
"updated_at": "2022-09-04T14:38:49.012783Z",
"structure_string": "Y1 Ga1 I1\n1.0\n5.560060 -0.000000 0.000000\n-2.780030 4.815153 -0.000000\n-0.000000 -0.000000 3.598426\nY Ga I\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Y\n0.000000 0.000000 0.000000 Ga\n0.333332 0.666666 0.000000 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Ga",
"I"
],
"chemical_system": "Ga-I-Y",
"density": 4.92157091268156,
"density_atomic": 0.031140035923021957,
"volume": 96.33900254373462,
"volume_molar": 19.338901133212268,
"formula_full": "Y1 Ga1 I1",
"formula_reduced": "YGaI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6225846833333335,
"spacegroup": 187
},
{
"id": "jvasp-114948",
"created_at": "2022-09-04T14:38:44.255477Z",
"updated_at": "2022-09-04T14:38:44.255505Z",
"structure_string": "Y1 Ga1 I4\n1.0\n-3.319514 3.319514 6.667452\n3.319514 -3.319514 6.667452\n3.319514 3.319514 -6.667452\nY Ga I\n1 1 4\ndirect\n0.500000 0.500000 0.000000 Y\n0.250000 0.749999 0.500000 Ga\n0.669064 0.157858 0.063224 I\n0.842142 0.905365 0.511206 I\n0.394159 0.330936 0.488793 I\n0.094634 0.605840 -0.063223 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Ga",
"I"
],
"chemical_system": "Ga-I-Y",
"density": 3.764569242029192,
"density_atomic": 0.020416549782481485,
"volume": 293.8792334612936,
"volume_molar": 29.49636850574687,
"formula_full": "Y1 Ga1 I4",
"formula_reduced": "YGaI4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0648688125000002,
"spacegroup": 82
},
{
"id": "jvasp-12031",
"created_at": "2022-09-04T14:37:11.443613Z",
"updated_at": "2022-09-04T14:37:11.443634Z",
"structure_string": "Y2 Ga2 I2\n1.0\n4.184375 -0.000000 0.000000\n-2.092187 3.623775 -0.000000\n-0.000000 -0.000000 11.435810\nY Ga I\n2 2 2\ndirect\n0.000000 0.000000 0.823845 Y\n0.000000 0.000000 0.176155 Y\n0.333333 0.666668 0.968885 Ga\n0.666666 0.333333 0.031115 Ga\n0.666666 0.333333 0.649656 I\n0.333333 0.666668 0.350344 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Ga",
"I"
],
"chemical_system": "Ga-I-Y",
"density": 5.468612285711746,
"density_atomic": 0.03460130638112812,
"volume": 173.40385747031956,
"volume_molar": 17.404373966887366,
"formula_full": "Y2 Ga2 I2",
"formula_reduced": "YGaI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2680146833333334,
"spacegroup": 164
},
{
"id": "jvasp-5683",
"created_at": "2022-09-04T14:36:50.627997Z",
"updated_at": "2022-09-04T14:36:50.628013Z",
"structure_string": "Ga2 Te2 I14\n1.0\n0.000000 7.236260 -0.131466\n7.211841 0.000000 0.000000\n0.000000 -3.787686 -15.378462\nGa Te I\n2 2 14\ndirect\n0.285443 0.490624 0.806823 Ga\n0.285443 0.509376 0.306823 Ga\n0.004778 0.084771 0.654878 Te\n0.004779 0.915229 0.154878 Te\n0.706034 0.125563 0.187305 I\n0.706034 0.874437 0.687305 I\n0.789038 0.669076 0.035513 I\n0.789038 0.330924 0.535512 I\n0.944444 0.616519 0.309703 I\n0.944444 0.383480 0.809703 I\n0.370818 0.378129 0.663968 I\n0.130179 0.862878 0.536643 I\n0.516244 0.678587 0.432465 I\n0.516244 0.321413 0.932465 I\n0.319320 0.156872 0.328653 I\n0.319320 0.843128 0.828653 I\n0.370819 0.621871 0.163968 I\n0.130179 0.137122 0.036643 I\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"Te",
"I"
],
"chemical_system": "Ga-I-Te",
"density": 4.472583420198663,
"density_atomic": 0.022328539072901298,
"volume": 806.1432027071326,
"volume_molar": 26.970599107886475,
"formula_full": "Ga2 Te2 I14",
"formula_reduced": "GaTeI7",
"formula_anonymous": "ABC7",
"energy_above_hull": 0.0,
"spacegroup": 7
},
{
"id": "jvasp-28429",
"created_at": "2022-09-04T14:36:59.209392Z",
"updated_at": "2022-09-04T14:36:59.209407Z",
"structure_string": "Tb2 Ga2 I2\n1.0\n-2.094277 -3.627394 -0.000000\n-2.094277 3.627394 0.000000\n-0.000000 0.000000 -11.453060\nTb Ga I\n2 2 2\ndirect\n0.000000 0.000000 0.824014 Tb\n0.000000 0.000000 0.175986 Tb\n0.666668 0.333334 0.968645 Ga\n0.333334 0.666668 0.031355 Ga\n0.666668 0.333334 0.350869 I\n0.333334 0.666668 0.649131 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"I"
],
"chemical_system": "Ga-I-Tb",
"density": 6.78582781516446,
"density_atomic": 0.034480286465031366,
"volume": 174.01247539184394,
"volume_molar": 17.465460346762008,
"formula_full": "Tb2 Ga2 I2",
"formula_reduced": "TbGaI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-116965",
"created_at": "2022-09-04T14:38:46.696082Z",
"updated_at": "2022-09-04T14:38:46.696105Z",
"structure_string": "Zr6 Ga16 Ir7\n1.0\n7.615474 -0.000000 4.396796\n2.538491 7.179938 4.396796\n0.000000 -0.000000 8.793592\nZr Ga Ir\n6 16 7\ndirect\n0.695880 0.695881 0.304120 Zr\n0.304119 0.695881 0.304120 Zr\n0.695880 0.304119 0.304120 Zr\n0.304119 0.304119 0.695881 Zr\n0.695880 0.304119 0.695881 Zr\n0.304119 0.695881 0.695881 Zr\n0.345787 0.345787 0.345787 Ga\n0.962640 0.345787 0.345788 Ga\n0.345786 0.962640 0.345788 Ga\n0.345787 0.345787 0.962640 Ga\n0.654213 0.654213 0.654214 Ga\n0.037360 0.654213 0.654213 Ga\n0.654213 0.037360 0.654213 Ga\n0.654213 0.654213 0.037361 Ga\n0.632562 0.122480 0.122480 Ga\n0.122479 0.632562 0.122480 Ga\n0.122479 0.122480 0.632562 Ga\n0.877520 0.877521 0.877521 Ga\n0.367437 0.877521 0.877521 Ga\n0.877520 0.367438 0.877521 Ga\n0.877520 0.877521 0.367439 Ga\n0.122479 0.122480 0.122480 Ga\n-0.000000 0.500000 0.000000 Ir\n0.000000 0.000000 0.000000 Ir\n0.000000 0.000000 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n-0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000001 Ir\n0.500000 0.000000 0.000000 Ir\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Zr",
"Ga",
"Ir"
],
"chemical_system": "Ga-Ir-Zr",
"density": 10.389752622453653,
"density_atomic": 0.060313433497158626,
"volume": 480.8215735449084,
"volume_molar": 9.984742056317693,
"formula_full": "Zr6 Ga16 Ir7",
"formula_reduced": "Zr6Ga16Ir7",
"formula_anonymous": "A6B7C16",
"energy_above_hull": 2.249113168965517,
"spacegroup": 225
},
{
"id": "jvasp-79073",
"created_at": "2022-09-04T14:36:36.408812Z",
"updated_at": "2022-09-04T14:36:36.408831Z",
"structure_string": "Zn1 Ga1 Ir2\n1.0\n0.000000 3.042553 3.042553\n3.042553 0.000000 3.042553\n3.042553 3.042553 -0.000000\nZn Ga Ir\n1 1 2\ndirect\n0.749998 0.749998 0.749998 Zn\n0.250001 0.250001 0.250001 Ga\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Ga",
"Ir"
],
"chemical_system": "Ga-Ir-Zn",
"density": 15.316000386882527,
"density_atomic": 0.07100935029766807,
"volume": 56.33060974691609,
"volume_molar": 8.480771524813916,
"formula_full": "Zn1 Ga1 Ir2",
"formula_reduced": "ZnGaIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7236537312499998,
"spacegroup": 225
}
]
}