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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=4138",
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{
"id": "jvasp-86910",
"created_at": "2022-09-04T14:36:21.227753Z",
"updated_at": "2022-09-04T14:36:21.227783Z",
"structure_string": "Li8 Si8\n1.0\n5.070572 0.000000 2.202471\n2.535286 7.323142 1.101235\n-0.382274 0.000000 7.818099\nLi Si\n8 8\ndirect\n0.672938 0.154251 0.000882 Li\n0.828072 0.345749 0.499118 Li\n0.326180 0.500882 0.845749 Li\n0.327063 0.845749 0.999118 Li\n0.171930 0.654251 0.500882 Li\n0.327189 0.000882 0.345749 Li\n0.673821 0.499118 0.154251 Li\n0.672812 0.999118 0.654251 Li\n0.328221 0.300170 0.581311 Si\n0.909532 0.918689 0.300170 Si\n0.671780 0.699830 0.418689 Si\n0.209702 0.199830 0.918689 Si\n0.128391 0.581311 0.199830 Si\n0.090469 0.081311 0.699830 Si\n0.871610 0.418689 0.800170 Si\n0.790299 0.800170 0.081311 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
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"formula_full": "Li8 Si8",
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"spacegroup": 88
},
{
"id": "jvasp-86307",
"created_at": "2022-09-04T14:35:56.490414Z",
"updated_at": "2022-09-04T14:35:56.490439Z",
"structure_string": "Li8 Si8\n1.0\n5.066658 0.000000 2.200771\n2.533328 7.328191 1.100386\n-0.386242 0.000000 7.821880\nLi Si\n8 8\ndirect\n0.673389 0.153913 0.000912 Li\n0.828212 0.346087 0.499088 Li\n0.325699 0.500912 0.846087 Li\n0.326612 0.846087 0.999088 Li\n0.171789 0.653913 0.500912 Li\n0.327303 0.000912 0.346087 Li\n0.674303 0.499088 0.153913 Li\n0.672698 0.999088 0.653913 Li\n0.328291 0.300170 0.581474 Si\n0.909765 0.918526 0.300170 Si\n0.671710 0.699830 0.418526 Si\n0.209933 0.199830 0.918526 Si\n0.128460 0.581474 0.199830 Si\n0.090236 0.081474 0.699830 Si\n0.871541 0.418526 0.800170 Si\n0.790068 0.800170 0.081474 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Li",
"Si"
],
"chemical_system": "Li-Si",
"density": 1.5685188219576158,
"density_atomic": 0.05393539824876835,
"volume": 296.6511886350143,
"volume_molar": 11.165470091133555,
"formula_full": "Li8 Si8",
"formula_reduced": "LiSi",
"formula_anonymous": "AB",
"energy_above_hull": 1.2414792999999995,
"spacegroup": 88
},
{
"id": "jvasp-115215",
"created_at": "2022-09-04T14:38:43.686380Z",
"updated_at": "2022-09-04T14:38:43.686407Z",
"structure_string": "Li1 Si1\n1.0\n2.588428 0.000000 0.000000\n0.000000 2.588428 0.000000\n0.000000 0.000000 4.973160\nLi Si\n1 1\ndirect\n0.000000 0.000000 -0.133253 Li\n0.000000 -0.000000 0.366778 Si\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Li",
"Si"
],
"chemical_system": "Li-Si",
"density": 1.7455859202298758,
"density_atomic": 0.060024062489436425,
"volume": 33.319970642639824,
"volume_molar": 10.032877666452235,
"formula_full": "Li1 Si1",
"formula_reduced": "LiSi",
"formula_anonymous": "AB",
"energy_above_hull": 1.3918142999999996,
"spacegroup": 123
},
{
"id": "jvasp-8663",
"created_at": "2022-09-04T14:37:08.175534Z",
"updated_at": "2022-09-04T14:37:08.175554Z",
"structure_string": "Li4 Si2\n1.0\n4.086257 -0.000000 1.465598\n1.782019 3.679489 1.460802\n-0.071711 -0.036324 6.629215\nLi Si\n4 2\ndirect\n0.643839 0.643920 0.068403 Li\n0.356162 0.356081 0.931596 Li\n0.205446 0.205490 0.383617 Li\n0.794554 0.794511 0.616381 Li\n0.937576 0.937696 0.187153 Si\n0.062425 0.062305 0.812846 Si\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Li",
"Si"
],
"chemical_system": "Li-Si",
"density": 1.391253127440459,
"density_atomic": 0.05989150296633369,
"volume": 100.18115597086835,
"volume_molar": 10.055083712601395,
"formula_full": "Li4 Si2",
"formula_reduced": "Li2Si",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2513161999999998,
"spacegroup": 166
},
{
"id": "jvasp-103702",
"created_at": "2022-09-04T14:36:54.603948Z",
"updated_at": "2022-09-04T14:36:54.603965Z",
"structure_string": "Li2 Si2\n1.0\n3.847426 0.000000 2.221312\n1.282475 3.627388 2.221312\n0.000000 0.000000 4.442625\nLi Si\n2 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.250001 0.250000 0.249999 Li\n0.750002 0.750000 0.749997 Si\n0.500001 0.500000 0.499998 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Si"
],
"chemical_system": "Li-Si",
"density": 1.8761687258772102,
"density_atomic": 0.0645143086557147,
"volume": 62.00174943121984,
"volume_molar": 9.334581561026395,
"formula_full": "Li2 Si2",
"formula_reduced": "LiSi",
"formula_anonymous": "AB",
"energy_above_hull": 1.2987142999999997,
"spacegroup": 227
},
{
"id": "jvasp-102524",
"created_at": "2022-09-04T14:36:52.406528Z",
"updated_at": "2022-09-04T14:36:52.406552Z",
"structure_string": "Li1 Si3\n1.0\n3.496964 -0.025153 -3.373746\n-0.648118 3.436471 -3.373746\n0.021006 0.025153 4.859061\nLi Si\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.750000 0.250000 0.499999 Si\n0.250000 0.750000 0.499999 Si\n0.499999 0.500000 -0.000001 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Si"
],
"chemical_system": "Li-Si",
"density": 2.5706397764971496,
"density_atomic": 0.06789990770655156,
"volume": 58.91024207701605,
"volume_molar": 8.869144249836637,
"formula_full": "Li1 Si3",
"formula_reduced": "LiSi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.58020895,
"spacegroup": 139
},
{
"id": "jvasp-38313",
"created_at": "2022-09-04T14:37:52.244961Z",
"updated_at": "2022-09-04T14:37:52.244985Z",
"structure_string": "Li2 Si6\n1.0\n5.473354 0.001827 0.008046\n-2.735096 4.741014 -0.008632\n0.006723 -0.004445 4.726868\nLi Si\n2 6\ndirect\n0.666468 0.333539 0.250003 Li\n0.333531 0.666462 0.750001 Li\n0.843360 0.156638 0.750128 Si\n0.312842 0.156263 0.749942 Si\n0.843735 0.687161 0.749930 Si\n0.156640 0.843363 0.249875 Si\n0.687156 0.843736 0.250060 Si\n0.156262 0.312838 0.250073 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Si"
],
"chemical_system": "Li-Si",
"density": 2.4687746983495202,
"density_atomic": 0.0652092820234115,
"volume": 122.68192121986303,
"volume_molar": 9.235097478665576,
"formula_full": "Li2 Si6",
"formula_reduced": "LiSi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.58110895,
"spacegroup": 194
},
{
"id": "jvasp-116301",
"created_at": "2022-09-04T14:38:42.412754Z",
"updated_at": "2022-09-04T14:38:42.412782Z",
"structure_string": "Li2 Se1\n1.0\n4.054516 0.000000 0.000000\n0.000000 4.754957 0.000000\n0.000000 0.000000 5.759319\nLi Se\n2 1\ndirect\n-0.033328 0.000000 0.786283 Li\n-0.033328 0.000000 0.213718 Li\n0.466657 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Se"
],
"chemical_system": "Li-Se",
"density": 1.3884710797806403,
"density_atomic": 0.027018703668117185,
"volume": 111.03419456574753,
"volume_molar": 22.288784961605295,
"formula_full": "Li2 Se1",
"formula_reduced": "Li2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5805511222222223,
"spacegroup": 47
},
{
"id": "jvasp-116300",
"created_at": "2022-09-04T14:38:41.621205Z",
"updated_at": "2022-09-04T14:38:41.621226Z",
"structure_string": "Li2 Se1\n1.0\n4.346944 0.000000 0.000000\n-2.173472 3.764564 -0.000000\n-0.000000 0.000000 4.502486\nLi Se\n2 1\ndirect\n0.333334 0.666666 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Se"
],
"chemical_system": "Li-Se",
"density": 2.092389266889299,
"density_atomic": 0.04071647323713972,
"volume": 73.68025178721855,
"volume_molar": 14.790428249829056,
"formula_full": "Li2 Se1",
"formula_reduced": "Li2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4676811222222223,
"spacegroup": 191
},
{
"id": "jvasp-116304",
"created_at": "2022-09-04T14:38:41.853863Z",
"updated_at": "2022-09-04T14:38:41.853889Z",
"structure_string": "Li1 Se2\n1.0\n4.235267 0.000000 0.043271\n0.000000 3.419865 0.000000\n-0.052427 0.000000 5.300201\nLi Se\n1 2\ndirect\n0.466638 0.000000 0.133275 Li\n-0.033186 0.000000 -0.150141 Se\n-0.033453 0.000000 0.416866 Se\n",
"nsites": 3,
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"elements": [
"Li",
"Se"
],
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"density": 3.565669146985825,
"density_atomic": 0.039074665653171525,
"volume": 76.77608879953405,
"volume_molar": 15.411880458435116,
"formula_full": "Li1 Se2",
"formula_reduced": "LiSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8768555777777779,
"spacegroup": 47
},
{
"id": "jvasp-116303",
"created_at": "2022-09-04T14:38:41.813693Z",
"updated_at": "2022-09-04T14:38:41.813724Z",
"structure_string": "Li2 Se1\n1.0\n4.062742 -0.712340 -0.970092\n1.642197 -3.877741 0.470275\n-0.651923 1.568482 -3.882351\nLi Se\n2 1\ndirect\n0.113735 0.534339 0.194674 Li\n0.613878 0.534165 0.694568 Li\n0.863785 0.034265 0.944619 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Se"
],
"chemical_system": "Li-Se",
"density": 2.8657163258769245,
"density_atomic": 0.055764892285683564,
"volume": 53.79728852753806,
"volume_molar": 10.799161467305579,
"formula_full": "Li2 Se1",
"formula_reduced": "Li2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3560744555555556,
"spacegroup": 225
},
{
"id": "jvasp-116305",
"created_at": "2022-09-04T14:38:41.230090Z",
"updated_at": "2022-09-04T14:38:41.230127Z",
"structure_string": "Li2 Se1\n1.0\n9.091301 -0.000000 0.000000\n-0.000000 9.091301 0.000000\n0.000000 -0.000000 11.224076\nLi Se\n2 1\ndirect\n0.000000 0.000000 0.194737 Li\n0.000000 0.000000 0.805263 Li\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Li-Se",
"density": 0.16618465217835335,
"density_atomic": 0.0032338403995461167,
"volume": 927.6895669993679,
"volume_molar": 186.22257180178818,
"formula_full": "Li2 Se1",
"formula_reduced": "Li2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8290911222222224,
"spacegroup": 123
}
]
}