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"results": [
{
"id": "jvasp-113663",
"created_at": "2022-09-04T14:38:43.261567Z",
"updated_at": "2022-09-04T14:38:43.261590Z",
"structure_string": "Li1 Br2\n1.0\n5.174686 -0.000000 -0.000000\n-2.587343 4.481410 -0.000000\n-0.000000 0.000000 4.181087\nLi Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.333334 0.666667 0.000000 Br\n0.666667 0.333333 0.000000 Br\n",
"nsites": 3,
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"elements": [
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"density": 2.8557780438916294,
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"volume": 96.95894588472817,
"volume_molar": 19.463347335301858,
"formula_full": "Li1 Br2",
"formula_reduced": "LiBr2",
"formula_anonymous": "AB2",
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},
{
"id": "jvasp-34772",
"created_at": "2022-09-04T14:38:15.867963Z",
"updated_at": "2022-09-04T14:38:15.867986Z",
"structure_string": "Li1 Br1\n1.0\n3.335656 -0.000000 1.925842\n1.111886 3.144887 1.925842\n-0.000000 0.000000 3.851684\nLi Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500001 0.500001 0.499998 Br\n",
"nsites": 2,
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"elements": [
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"volume": 40.40517118470263,
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"formula_full": "Li1 Br1",
"formula_reduced": "LiBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0228549999999998,
"spacegroup": 225
},
{
"id": "jvasp-113662",
"created_at": "2022-09-04T14:38:48.159002Z",
"updated_at": "2022-09-04T14:38:48.159026Z",
"structure_string": "Li1 Br2\n1.0\n4.219697 0.713139 -0.046354\n-1.140942 -5.632288 -0.052105\n0.322959 3.260294 -3.415423\nLi Br\n1 2\ndirect\n-0.012117 0.031606 0.027075 Li\n0.132932 0.885436 0.381237 Br\n0.618170 0.400422 0.396326 Br\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Br-Li",
"density": 3.4967094471903812,
"density_atomic": 0.03788510245053227,
"volume": 79.18679918886828,
"volume_molar": 15.895801701640618,
"formula_full": "Li1 Br2",
"formula_reduced": "LiBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2341847016666666,
"spacegroup": 5
},
{
"id": "jvasp-113667",
"created_at": "2022-09-04T14:38:48.214282Z",
"updated_at": "2022-09-04T14:38:48.214310Z",
"structure_string": "Li2 Br2\n1.0\n3.865781 0.000000 -0.000000\n0.000000 3.865781 0.000000\n-0.000000 0.000000 5.474660\nLi Br\n2 2\ndirect\n0.000000 0.000000 0.249904 Li\n0.500000 0.500000 0.750096 Li\n0.000000 0.000000 0.750030 Br\n0.500000 0.500000 0.249970 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Br"
],
"chemical_system": "Br-Li",
"density": 3.5252690279883296,
"density_atomic": 0.048890935139042246,
"volume": 81.81475745195489,
"volume_molar": 12.317499640523282,
"formula_full": "Li2 Br2",
"formula_reduced": "LiBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-113665",
"created_at": "2022-09-04T14:38:48.204773Z",
"updated_at": "2022-09-04T14:38:48.204802Z",
"structure_string": "Li2 Br2\n1.0\n3.952426 -0.321994 -0.803995\n-2.005360 -3.421489 0.954184\n0.069554 -0.162816 -6.924498\nLi Br\n2 2\ndirect\n0.924372 0.006467 0.919606 Li\n0.424029 0.505860 0.419653 Li\n0.553675 0.383886 0.044953 Br\n0.053405 0.883326 0.544938 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Br"
],
"chemical_system": "Br-Li",
"density": 2.9355233545475783,
"density_atomic": 0.040711923199866634,
"volume": 98.25131523172807,
"volume_molar": 14.792081254514963,
"formula_full": "Li2 Br2",
"formula_reduced": "LiBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.006345,
"spacegroup": 119
},
{
"id": "jvasp-113666",
"created_at": "2022-09-04T14:38:48.556496Z",
"updated_at": "2022-09-04T14:38:48.556520Z",
"structure_string": "Li2 Br1\n1.0\n3.680044 0.196544 -0.039845\n2.003323 -3.079570 -0.287546\n-0.186094 0.544827 -5.951908\nLi Br\n2 1\ndirect\n0.800074 0.560618 0.319563 Li\n0.460623 0.221132 0.780457 Li\n0.130345 0.890872 0.050002 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Br"
],
"chemical_system": "Br-Li",
"density": 2.2133254135920253,
"density_atomic": 0.0426362906817945,
"volume": 70.36259374413605,
"volume_molar": 14.124448125529423,
"formula_full": "Li2 Br1",
"formula_reduced": "Li2Br",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4906266666666665,
"spacegroup": 164
},
{
"id": "jvasp-113664",
"created_at": "2022-09-04T14:38:45.557329Z",
"updated_at": "2022-09-04T14:38:45.557362Z",
"structure_string": "Li2 Br1\n1.0\n3.659341 0.000000 0.000000\n0.000000 3.720123 0.000000\n0.000000 0.000000 6.275655\nLi Br\n2 1\ndirect\n-0.033319 0.000000 0.733276 Li\n-0.033319 0.000000 0.266724 Li\n0.466637 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Br"
],
"chemical_system": "Br-Li",
"density": 1.822921089800337,
"density_atomic": 0.03511575523301117,
"volume": 85.43173797896274,
"volume_molar": 17.149398382691718,
"formula_full": "Li2 Br1",
"formula_reduced": "Li2Br",
"formula_anonymous": "AB2",
"energy_above_hull": 0.54291,
"spacegroup": 47
},
{
"id": "jvasp-38538",
"created_at": "2022-09-04T14:38:00.843209Z",
"updated_at": "2022-09-04T14:38:00.843227Z",
"structure_string": "Li2 Br2\n1.0\n2.062195 -3.571826 0.000000\n2.062195 3.571826 0.000000\n0.000000 -0.000000 6.655743\nLi Br\n2 2\ndirect\n0.333334 0.666668 0.376848 Li\n0.666668 0.333334 0.876848 Li\n0.333334 0.666668 0.998149 Br\n0.666668 0.333334 0.498150 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Br"
],
"chemical_system": "Br-Li",
"density": 2.9415575469847877,
"density_atomic": 0.040795609667118315,
"volume": 98.04976644886476,
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"formula_full": "Li2 Br2",
"formula_reduced": "LiBr",
"formula_anonymous": "AB",
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"spacegroup": 186
},
{
"id": "jvasp-113659",
"created_at": "2022-09-04T14:38:46.735397Z",
"updated_at": "2022-09-04T14:38:46.735421Z",
"structure_string": "Li1 Bi2\n1.0\n5.459916 0.000000 -2.721822\n0.000000 3.272323 0.000000\n-1.587723 0.000000 5.891236\nLi Bi\n1 2\ndirect\n0.086767 0.000000 0.421452 Li\n-0.268023 0.000000 -0.223790 Bi\n0.441778 0.000000 0.066492 Bi\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Bi"
],
"chemical_system": "Bi-Li",
"density": 7.743681315337699,
"density_atomic": 0.03292539986721247,
"volume": 91.11506654737512,
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"formula_full": "Li1 Bi2",
"formula_reduced": "LiBi2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6971528666666666,
"spacegroup": 65
},
{
"id": "jvasp-114327",
"created_at": "2022-09-04T14:38:41.418307Z",
"updated_at": "2022-09-04T14:38:41.418332Z",
"structure_string": "Li2 Bi1\n1.0\n4.943357 -0.000000 -0.000000\n-2.471678 4.281072 0.000000\n-0.000000 -0.000000 3.470053\nLi Bi\n2 1\ndirect\n0.333332 0.666666 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 3,
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"elements": [
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"density_atomic": 0.04085174752448554,
"volume": 73.43627095026653,
"volume_molar": 14.741452018400132,
"formula_full": "Li2 Bi1",
"formula_reduced": "Li2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5353181,
"spacegroup": 191
},
{
"id": "jvasp-113658",
"created_at": "2022-09-04T14:38:50.797638Z",
"updated_at": "2022-09-04T14:38:50.797666Z",
"structure_string": "Li2 Bi1\n1.0\n4.786423 0.000000 -1.236963\n0.000000 3.443124 0.000000\n-1.316887 0.000000 4.759293\nLi Bi\n2 1\ndirect\n-0.199768 0.000000 -0.199608 Li\n0.133078 0.000000 0.466274 Li\n0.466690 0.000000 0.133333 Bi\n",
"nsites": 3,
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"volume": 72.82568438459592,
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"formula_full": "Li2 Bi1",
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},
{
"id": "jvasp-8581",
"created_at": "2022-09-04T14:37:02.685679Z",
"updated_at": "2022-09-04T14:37:02.685709Z",
"structure_string": "Li3 Bi1\n1.0\n4.101908 0.000000 2.368237\n1.367303 3.867316 2.368237\n0.000000 0.000000 4.736475\nLi Bi\n3 1\ndirect\n0.750000 0.750001 0.750001 Li\n0.500000 0.500001 0.500001 Li\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
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"formula_full": "Li3 Bi1",
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"spacegroup": 225
}
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}