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=-energy_above_hull&page=4029",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4027",
"results": [
{
"id": "jvasp-105466",
"created_at": "2022-09-04T14:36:58.889763Z",
"updated_at": "2022-09-04T14:36:58.889794Z",
"structure_string": "La1 Ce1 In6\n1.0\n4.748633 0.000000 0.000000\n0.000000 4.748633 0.000000\n0.000000 0.000000 9.501883\nLa Ce In\n1 1 6\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 -0.000000 In\n0.500000 0.500000 0.500000 In\n0.500000 0.000000 0.245814 In\n0.500000 0.000000 0.754186 In\n-0.000000 0.500000 0.245814 In\n-0.000000 0.500000 0.754186 In\n",
"nsites": 8,
"nelements": 3,
"elements": [
"La",
"Ce",
"In"
],
"chemical_system": "Ce-In-La",
"density": 7.501462097086324,
"density_atomic": 0.037337316050575546,
"volume": 214.26285673998473,
"volume_molar": 16.129013536598784,
"formula_full": "La1 Ce1 In6",
"formula_reduced": "LaCeIn6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.10297254,
"spacegroup": 123
},
{
"id": "jvasp-103585",
"created_at": "2022-09-04T14:36:48.525879Z",
"updated_at": "2022-09-04T14:36:48.525901Z",
"structure_string": "Al1 Ga3\n1.0\n3.771810 0.062452 -3.861502\n-0.581930 3.727171 -3.861502\n-0.052569 -0.062452 5.397683\nAl Ga\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.750000 0.250000 0.500000 Ga\n0.250000 0.750000 0.500000 Ga\n0.500000 0.500000 -0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Ga"
],
"chemical_system": "Al-Ga",
"density": 5.278898298927789,
"density_atomic": 0.053847463255125086,
"volume": 74.28390787971406,
"volume_molar": 11.183703736362782,
"formula_full": "Al1 Ga3",
"formula_reduced": "AlGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.10289244375,
"spacegroup": 139
},
{
"id": "jvasp-79222",
"created_at": "2022-09-04T14:36:47.903028Z",
"updated_at": "2022-09-04T14:36:47.903047Z",
"structure_string": "Mg3 Ga1\n1.0\n3.206211 -0.000000 0.000000\n-1.603106 2.776660 -0.000000\n-0.000000 0.000000 9.607387\nMg Ga\n3 1\ndirect\n0.666666 0.333333 0.000000 Mg\n0.000000 0.000000 0.732645 Mg\n0.000000 0.000000 0.267355 Mg\n0.666666 0.333333 0.500000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Ga"
],
"chemical_system": "Ga-Mg",
"density": 2.7692632948864015,
"density_atomic": 0.04676704207594184,
"volume": 85.53031841322507,
"volume_molar": 12.876890418301532,
"formula_full": "Mg3 Ga1",
"formula_reduced": "Mg3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1028685,
"spacegroup": 187
},
{
"id": "jvasp-3861",
"created_at": "2022-09-04T14:36:13.293611Z",
"updated_at": "2022-09-04T14:36:13.293622Z",
"structure_string": "Sm2 Cl2 O2\n1.0\n3.993869 0.000000 0.000000\n0.000000 3.993869 -0.000000\n0.000000 0.000000 6.718750\nSm Cl O\n2 2 2\ndirect\n0.500000 0.000000 0.173832 Sm\n0.000000 0.500000 0.826168 Sm\n0.500000 0.000000 0.627150 Cl\n0.000000 0.500000 0.372850 Cl\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Cl",
"O"
],
"chemical_system": "Cl-O-Sm",
"density": 6.25389848126357,
"density_atomic": 0.05598544534320176,
"volume": 107.17071130217548,
"volume_molar": 10.756618480183727,
"formula_full": "Sm2 Cl2 O2",
"formula_reduced": "SmClO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1028554808333332,
"spacegroup": 129
},
{
"id": "jvasp-94727",
"created_at": "2022-09-04T14:36:19.552153Z",
"updated_at": "2022-09-04T14:36:19.552176Z",
"structure_string": "Ca1 Mg6 C1\n1.0\n10.003841 2.496855 0.000000\n-2.839580 4.918297 0.000000\n0.000000 0.000000 3.476441\nCa Mg C\n1 6 1\ndirect\n0.076301 0.288150 0.250000 Ca\n0.577785 0.284353 0.250000 Mg\n0.577785 0.793432 0.250000 Mg\n0.334986 0.149304 0.750000 Mg\n0.334986 0.685685 0.750000 Mg\n0.795891 0.147947 0.750000 Mg\n0.906474 0.703238 0.750000 Mg\n0.395793 0.947898 0.250000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"C"
],
"chemical_system": "C-Ca-Mg",
"density": 1.679404472200331,
"density_atomic": 0.04087985674141533,
"volume": 195.6954020314658,
"volume_molar": 14.73131571397846,
"formula_full": "Ca1 Mg6 C1",
"formula_reduced": "CaMg6C",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.1028155899999999,
"spacegroup": 38
},
{
"id": "jvasp-14694",
"created_at": "2022-09-04T14:36:59.560676Z",
"updated_at": "2022-09-04T14:36:59.560696Z",
"structure_string": "Er1 Ga3\n1.0\n4.242500 -0.000000 -0.000000\n0.000000 4.242500 -0.000000\n-0.000000 -0.000000 4.242500\nEr Ga\n1 3\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.000000 0.500000 Ga\n0.000000 0.500000 0.500000 Ga\n0.500000 0.500000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Er",
"Ga"
],
"chemical_system": "Er-Ga",
"density": 8.185881713247394,
"density_atomic": 0.0523834910675312,
"volume": 76.35993551562498,
"volume_molar": 11.49625700249042,
"formula_full": "Er1 Ga3",
"formula_reduced": "ErGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1026199999999999,
"spacegroup": 221
},
{
"id": "jvasp-91",
"created_at": "2022-09-04T14:37:38.381693Z",
"updated_at": "2022-09-04T14:37:38.381720Z",
"structure_string": "C2\n1.0\n2.187469 -0.000000 1.262935\n0.729157 2.062365 1.262935\n0.000000 0.000000 2.525872\nC\n2\ndirect\n0.875001 0.875002 0.875001 C\n0.125000 0.125000 0.125000 C\n",
"nsites": 2,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.5004883536652334,
"density_atomic": 0.17551378022761074,
"volume": 11.395116653554775,
"volume_molar": 3.4311498232163506,
"formula_full": "C2",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.1023800000000001,
"spacegroup": 227
},
{
"id": "jvasp-25306",
"created_at": "2022-09-04T14:37:59.079313Z",
"updated_at": "2022-09-04T14:37:59.079336Z",
"structure_string": "C2\n1.0\n2.187469 -0.000000 1.262935\n0.729157 2.062365 1.262935\n0.000000 0.000000 2.525872\nC\n2\ndirect\n0.875001 0.875002 0.875001 C\n0.125000 0.125000 0.125000 C\n",
"nsites": 2,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.5004883536652334,
"density_atomic": 0.17551378022761074,
"volume": 11.395116653554775,
"volume_molar": 3.4311498232163506,
"formula_full": "C2",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.1023800000000001,
"spacegroup": 227
},
{
"id": "jvasp-18953",
"created_at": "2022-09-04T14:36:21.927060Z",
"updated_at": "2022-09-04T14:36:21.927087Z",
"structure_string": "Mg6 Hg2\n1.0\n2.421008 -4.193310 0.000000\n2.421008 4.193310 -0.000000\n0.000000 -0.000000 8.642268\nMg Hg\n6 2\ndirect\n0.666667 0.333333 0.077473 Mg\n0.333333 0.666667 0.577473 Mg\n0.000000 0.000000 0.750000 Mg\n0.000000 0.000000 0.250000 Mg\n0.666667 0.333333 0.422528 Mg\n0.333333 0.666667 0.922528 Mg\n0.333333 0.666667 0.250000 Hg\n0.666667 0.333333 0.750000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg",
"density": 5.176466925555758,
"density_atomic": 0.045590994645003324,
"volume": 175.47324997606262,
"volume_molar": 13.209057637131446,
"formula_full": "Mg6 Hg2",
"formula_reduced": "Mg3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1023670833333333,
"spacegroup": 194
},
{
"id": "jvasp-120945",
"created_at": "2022-09-04T14:38:53.530344Z",
"updated_at": "2022-09-04T14:38:53.530368Z",
"structure_string": "Ca2 Br1\n1.0\n3.688687 0.000000 0.000000\n0.000000 3.756475 0.000000\n0.000000 0.000000 8.335285\nCa Br\n2 1\ndirect\n-0.033349 0.000000 0.714825 Ca\n-0.033349 0.000000 0.285176 Ca\n0.466698 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"Br"
],
"chemical_system": "Br-Ca",
"density": 2.3012253429640146,
"density_atomic": 0.02597457754704056,
"volume": 115.4975473447809,
"volume_molar": 23.184749584834496,
"formula_full": "Ca2 Br1",
"formula_reduced": "Ca2Br",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1020401400000001,
"spacegroup": 47
},
{
"id": "jvasp-93698",
"created_at": "2022-09-04T14:36:09.348277Z",
"updated_at": "2022-09-04T14:36:09.348302Z",
"structure_string": "In4 Bi2\n1.0\n-2.779775 -4.812796 -0.000000\n-2.779775 4.812796 0.000000\n0.000000 -0.000000 -6.709997\nIn Bi\n4 2\ndirect\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.666756 0.333246 0.250000 In\n0.333246 0.666756 0.750000 In\n0.666645 0.333357 0.750000 Bi\n0.333357 0.666645 0.250000 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"In",
"Bi"
],
"chemical_system": "Bi-In",
"density": 8.11343085116633,
"density_atomic": 0.033418875342419004,
"volume": 179.53925554113798,
"volume_molar": 18.02017781357238,
"formula_full": "In4 Bi2",
"formula_reduced": "In2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1020238111111111,
"spacegroup": 194
},
{
"id": "jvasp-120295",
"created_at": "2022-09-04T14:38:53.632201Z",
"updated_at": "2022-09-04T14:38:53.632227Z",
"structure_string": "Li1 Zn1 O1\n1.0\n2.453735 1.457506 0.000000\n1.022964 6.585039 0.000000\n0.000000 0.000000 3.275376\nLi Zn O\n1 1 1\ndirect\n-0.080259 -0.133457 0.000000 Li\n0.208526 0.344533 0.000000 Zn\n0.087746 0.089684 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Zn",
"O"
],
"chemical_system": "Li-O-Zn",
"density": 3.0538752943696057,
"density_atomic": 0.062448189436042655,
"volume": 48.03982352558835,
"volume_molar": 9.643419311888419,
"formula_full": "Li1 Zn1 O1",
"formula_reduced": "LiZnO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1017579666666668,
"spacegroup": 38
}
]
}