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=-formula_full&page=4454",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=4452",
"results": [
{
"id": "jvasp-69238",
"created_at": "2022-09-04T14:36:18.349594Z",
"updated_at": "2022-09-04T14:36:18.349618Z",
"structure_string": "Ba1 Ca1 Cr4\n1.0\n0.000000 4.214232 4.214232\n4.214232 -0.000000 4.214232\n4.214232 4.214232 0.000000\nBa Ca Cr\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Ca\n0.121704 0.626098 0.626098 Cr\n0.626098 0.626098 0.626098 Cr\n0.626098 0.121704 0.626098 Cr\n0.626098 0.626098 0.121704 Cr\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Cr"
],
"chemical_system": "Ba-Ca-Cr",
"density": 4.275269983280356,
"density_atomic": 0.040083527417019524,
"volume": 149.687424900943,
"volume_molar": 15.023979045923463,
"formula_full": "Ba1 Ca1 Cr4",
"formula_reduced": "BaCaCr4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.588720998333333,
"spacegroup": 216
},
{
"id": "jvasp-66682",
"created_at": "2022-09-04T14:35:53.844179Z",
"updated_at": "2022-09-04T14:35:53.844208Z",
"structure_string": "Ba1 Ca1 Cr1\n1.0\n0.000000 3.958063 3.958063\n3.958063 -0.000000 3.958063\n3.958063 3.958063 0.000000\nBa Ca Cr\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Cr\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Cr"
],
"chemical_system": "Ba-Ca-Cr",
"density": 3.0716129523023827,
"density_atomic": 0.024190405667710208,
"volume": 124.01610957704833,
"volume_molar": 24.894748946018968,
"formula_full": "Ba1 Ca1 Cr1",
"formula_reduced": "BaCaCr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5867579299999997,
"spacegroup": 216
},
{
"id": "jvasp-9366",
"created_at": "2022-09-04T14:37:27.978486Z",
"updated_at": "2022-09-04T14:37:27.978514Z",
"structure_string": "Ba1 Ca1 Co4 O8\n1.0\n2.641549 -4.575296 -0.000000\n2.641549 4.575296 0.000000\n-0.000000 -0.000000 7.749837\nBa Ca Co O\n1 1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ca\n0.333333 0.666667 0.766200 Co\n0.666667 0.333333 0.766200 Co\n0.333333 0.666667 0.233801 Co\n0.666667 0.333333 0.233801 Co\n0.660923 -0.000000 0.697824 O\n-0.000000 0.660923 0.697824 O\n0.339078 0.339078 0.697824 O\n0.339078 -0.000000 0.302177 O\n0.660922 0.660922 0.302177 O\n-0.000000 0.339078 0.302177 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Ca",
"Co",
"O"
],
"chemical_system": "Ba-Ca-Co-O",
"density": 4.796811691251781,
"density_atomic": 0.0747356135999704,
"volume": 187.32702289615705,
"volume_molar": 8.057926428802862,
"formula_full": "Ba1 Ca1 Co4 O8",
"formula_reduced": "BaCa(CoO2)4",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.687344856428571,
"spacegroup": 162
},
{
"id": "jvasp-64354",
"created_at": "2022-09-04T14:36:12.757355Z",
"updated_at": "2022-09-04T14:36:12.757369Z",
"structure_string": "Ba1 Ca1 Cl1\n1.0\n-0.000000 4.112230 4.112230\n4.112230 -0.000000 4.112230\n4.112230 4.112230 -0.000000\nBa Ca Cl\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Cl"
],
"chemical_system": "Ba-Ca-Cl",
"density": 2.5414226010732013,
"density_atomic": 0.021570443168117466,
"volume": 139.07920095189317,
"volume_molar": 27.918484164020892,
"formula_full": "Ba1 Ca1 Cl1",
"formula_reduced": "BaCaCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-66142",
"created_at": "2022-09-04T14:35:59.913331Z",
"updated_at": "2022-09-04T14:35:59.913358Z",
"structure_string": "Ba1 Ca1 Cd1\n1.0\n-0.000000 4.024586 4.024586\n4.024586 -0.000000 4.024586\n4.024586 4.024586 -0.000000\nBa Ca Cd\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Cd"
],
"chemical_system": "Ba-Ca-Cd",
"density": 3.6912870879169852,
"density_atomic": 0.02301058302856495,
"volume": 130.3747930365715,
"volume_molar": 26.17117850740338,
"formula_full": "Ba1 Ca1 Cd1",
"formula_reduced": "BaCaCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-68960",
"created_at": "2022-09-04T14:36:18.665418Z",
"updated_at": "2022-09-04T14:36:18.665434Z",
"structure_string": "Ba1 Ca1 Br2\n1.0\n4.202621 0.000000 0.000000\n0.000000 4.202621 0.000000\n0.000000 0.000000 7.942024\nBa Ca Br\n1 1 2\ndirect\n0.500000 0.500000 0.810577 Ba\n0.000000 0.000000 0.389702 Ca\n0.000000 0.000000 0.006735 Br\n0.500000 0.500000 0.292985 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 3.991919350974669,
"density_atomic": 0.028515982767503004,
"volume": 140.27221269604726,
"volume_molar": 21.118475239306395,
"formula_full": "Ba1 Ca1 Br2",
"formula_reduced": "BaCaBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0074349999999999,
"spacegroup": 99
},
{
"id": "jvasp-119932",
"created_at": "2022-09-04T14:38:49.052174Z",
"updated_at": "2022-09-04T14:38:49.052193Z",
"structure_string": "Ba1 Ca1 Br2\n1.0\n4.212349 0.000000 -0.000000\n0.000000 4.212349 0.000000\n-0.000000 0.000000 7.942599\nBa Ca Br\n1 1 2\ndirect\n0.500001 0.500001 0.809150 Ba\n0.000000 0.000000 0.392423 Ca\n0.000000 0.000000 0.007015 Br\n0.500001 0.500001 0.291412 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 3.9732151022833286,
"density_atomic": 0.02838237034038042,
"volume": 140.93255609131012,
"volume_molar": 21.217892261211627,
"formula_full": "Ba1 Ca1 Br2",
"formula_reduced": "BaCaBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-69163",
"created_at": "2022-09-04T14:35:47.122262Z",
"updated_at": "2022-09-04T14:35:47.122297Z",
"structure_string": "Ba1 Ca1 Br2\n1.0\n4.202282 0.000000 0.000000\n0.000000 4.202128 0.000000\n0.000000 0.000000 7.943162\nBa Ca Br\n1 1 2\ndirect\n0.500000 0.500000 0.810460 Ba\n0.000000 0.000000 0.389650 Ca\n0.000000 0.000000 0.006793 Br\n0.500000 0.500000 0.293095 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 3.9921377296369007,
"density_atomic": 0.028517542739441685,
"volume": 140.26453949932124,
"volume_molar": 21.11732001253731,
"formula_full": "Ba1 Ca1 Br2",
"formula_reduced": "BaCaBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.00744,
"spacegroup": 99
},
{
"id": "jvasp-69288",
"created_at": "2022-09-04T14:35:59.733628Z",
"updated_at": "2022-09-04T14:35:59.733655Z",
"structure_string": "Ba1 Ca1 Br2\n1.0\n4.202532 0.000000 0.000000\n0.000000 4.202532 0.000000\n-0.000000 0.000000 7.942601\nBa Ca Br\n1 1 2\ndirect\n0.500000 0.500000 0.810464 Ba\n0.000000 0.000000 0.389647 Ca\n0.000000 0.000000 0.006764 Br\n0.500000 0.500000 0.293124 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 3.991798422013364,
"density_atomic": 0.02851511892034742,
"volume": 140.2764621523544,
"volume_molar": 21.11911500990727,
"formula_full": "Ba1 Ca1 Br2",
"formula_reduced": "BaCaBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.00744,
"spacegroup": 99
},
{
"id": "jvasp-64334",
"created_at": "2022-09-04T14:35:57.619527Z",
"updated_at": "2022-09-04T14:35:57.619549Z",
"structure_string": "Ba1 Ca1 Br1\n1.0\n0.000000 4.185483 4.185483\n4.185483 -0.000000 4.185483\n4.185483 4.185483 -0.000000\nBa Ca Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 2.913649668305549,
"density_atomic": 0.0204575919621082,
"volume": 146.6448253321621,
"volume_molar": 29.437192662529796,
"formula_full": "Ba1 Ca1 Br1",
"formula_reduced": "BaCaBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1585999999999998,
"spacegroup": 216
},
{
"id": "jvasp-119931",
"created_at": "2022-09-04T14:38:54.262029Z",
"updated_at": "2022-09-04T14:38:54.262056Z",
"structure_string": "Ba1 Ca1 Br1\n1.0\n5.995360 2.649922 0.000000\n3.360879 7.691847 0.000000\n0.000000 0.000000 3.947361\nBa Ca Br\n1 1 1\ndirect\n-0.047523 -0.042083 0.000000 Ba\n-0.047667 0.458052 0.000000 Ca\n0.452287 -0.041932 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 2.909011519843831,
"density_atomic": 0.020425026156506494,
"volume": 146.87863687480933,
"volume_molar": 29.484127529900945,
"formula_full": "Ba1 Ca1 Br1",
"formula_reduced": "BaCaBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 10
},
{
"id": "jvasp-119930",
"created_at": "2022-09-04T14:38:53.930154Z",
"updated_at": "2022-09-04T14:38:53.930181Z",
"structure_string": "Ba1 Ca1 Br1\n1.0\n3.962649 0.000000 -0.000000\n0.000000 3.962649 0.000000\n-0.000000 0.000000 9.689887\nBa Ca Br\n1 1 1\ndirect\n0.000000 0.000000 0.422571 Ba\n0.000000 0.000000 0.021687 Ca\n0.000000 0.000000 0.740900 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 2.8081102255315127,
"density_atomic": 0.01971656846856131,
"volume": 152.1562945795357,
"volume_molar": 30.54355411593297,
"formula_full": "Ba1 Ca1 Br1",
"formula_reduced": "BaCaBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0400833333333332,
"spacegroup": 99
}
]
}