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=220",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=218",
"results": [
{
"id": "jvasp-114575",
"created_at": "2022-09-04T14:38:42.483363Z",
"updated_at": "2022-09-04T14:38:42.483391Z",
"structure_string": "Ba1 I1 O1\n1.0\n6.121102 0.000000 0.000000\n0.000000 6.121102 -0.000000\n0.000000 0.000000 7.768293\nBa I O\n1 1 1\ndirect\n0.000000 0.000000 -0.010918 Ba\n0.000000 0.000000 0.404234 I\n0.000000 0.000000 0.711826 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"I",
"O"
],
"chemical_system": "Ba-I-O",
"density": 1.5987488382297508,
"density_atomic": 0.010307098443900799,
"volume": 291.06154523781066,
"volume_molar": 58.42711984150679,
"formula_full": "Ba1 I1 O1",
"formula_reduced": "BaIO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4961872499999999,
"spacegroup": 99
},
{
"id": "jvasp-114574",
"created_at": "2022-09-04T14:38:42.393556Z",
"updated_at": "2022-09-04T14:38:42.393592Z",
"structure_string": "Ba1 I1 O2\n1.0\n3.921507 0.000000 -0.000000\n0.000000 3.921507 0.000000\n0.000000 0.000000 5.355540\nBa I O\n1 1 2\ndirect\n0.500000 0.500000 0.502486 Ba\n0.000000 0.000000 0.002471 I\n0.000000 0.000000 0.502530 O\n0.500000 0.500000 0.002512 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"I",
"O"
],
"chemical_system": "Ba-I-O",
"density": 5.972680389384064,
"density_atomic": 0.04856805758816251,
"volume": 82.35865708112897,
"volume_molar": 12.399385643678235,
"formula_full": "Ba1 I1 O2",
"formula_reduced": "BaIO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8708338125000001,
"spacegroup": 123
},
{
"id": "jvasp-113486",
"created_at": "2022-09-04T14:38:49.417117Z",
"updated_at": "2022-09-04T14:38:49.417145Z",
"structure_string": "Ba1 I2\n1.0\n5.493711 1.872449 0.860099\n-4.080292 -7.070138 1.433951\n-2.390570 0.271859 -5.332320\nBa I\n1 2\ndirect\n0.703840 0.053436 0.178721 Ba\n0.704009 0.303902 0.678135 I\n0.703549 0.802906 0.679195 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"I"
],
"chemical_system": "Ba-I",
"density": 4.563536579925561,
"density_atomic": 0.02107880420593771,
"volume": 142.3230639978584,
"volume_molar": 28.569650826319723,
"formula_full": "Ba1 I2",
"formula_reduced": "BaI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0042866666666667,
"spacegroup": 225
},
{
"id": "jvasp-113480",
"created_at": "2022-09-04T14:38:48.168068Z",
"updated_at": "2022-09-04T14:38:48.168095Z",
"structure_string": "Ba1 I2\n1.0\n4.938912 0.000000 0.000000\n0.000000 5.462895 0.000000\n0.000000 0.000000 8.765572\nBa I\n1 2\ndirect\n0.466687 0.000000 0.000000 Ba\n-0.033344 0.000000 0.741396 I\n-0.033344 0.000000 0.258603 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"I"
],
"chemical_system": "Ba-I",
"density": 2.7462648495623974,
"density_atomic": 0.012684894280505364,
"volume": 236.501773973041,
"volume_molar": 47.47489909517857,
"formula_full": "Ba1 I2",
"formula_reduced": "BaI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1760533333333333,
"spacegroup": 47
},
{
"id": "jvasp-113473",
"created_at": "2022-09-04T14:38:47.184721Z",
"updated_at": "2022-09-04T14:38:47.184749Z",
"structure_string": "Ba1 I2\n1.0\n6.251025 -0.000000 -0.000000\n-3.125512 5.413546 0.000000\n0.000000 -0.000000 5.300897\nBa I\n1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666667 0.000000 I\n0.666666 0.333334 0.000000 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"I"
],
"chemical_system": "Ba-I",
"density": 3.620715390263329,
"density_atomic": 0.016723948512324838,
"volume": 179.38347500825705,
"volume_molar": 36.00908455058887,
"formula_full": "Ba1 I2",
"formula_reduced": "BaI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.18931,
"spacegroup": 191
},
{
"id": "jvasp-66106",
"created_at": "2022-09-04T14:35:58.336169Z",
"updated_at": "2022-09-04T14:35:58.336204Z",
"structure_string": "Ba1 In1 Bi1\n1.0\n0.000000 4.008347 4.008347\n4.008347 -0.000000 4.008347\n4.008347 4.008347 0.000000\nBa In Bi\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"Bi"
],
"chemical_system": "Ba-Bi-In",
"density": 5.944867966472821,
"density_atomic": 0.023291385622708896,
"volume": 128.80298530092716,
"volume_molar": 25.855656926346477,
"formula_full": "Ba1 In1 Bi1",
"formula_reduced": "BaInBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-115546",
"created_at": "2022-09-04T14:38:50.359358Z",
"updated_at": "2022-09-04T14:38:50.359384Z",
"structure_string": "Ba1 In1 Br1\n1.0\n6.028461 1.715797 0.000000\n2.025017 6.894059 0.000000\n0.000000 0.000000 3.848421\nBa In Br\n1 1 1\ndirect\n-0.047089 -0.051327 0.000000 Ba\n-0.048187 0.449178 0.000000 In\n0.452373 -0.050422 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"Br"
],
"chemical_system": "Ba-Br-In",
"density": 3.761861404050427,
"density_atomic": 0.02046787573758554,
"volume": 146.57114585130319,
"volume_molar": 29.422402389034595,
"formula_full": "Ba1 In1 Br1",
"formula_reduced": "BaInBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0033733333333332,
"spacegroup": 10
},
{
"id": "jvasp-66494",
"created_at": "2022-09-04T14:35:57.509132Z",
"updated_at": "2022-09-04T14:35:57.509158Z",
"structure_string": "Ba1 In1 Br1\n1.0\n0.000000 4.018357 4.018357\n4.018357 0.000000 4.018357\n4.018357 4.018357 0.000000\nBa In Br\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"Br"
],
"chemical_system": "Ba-Br-In",
"density": 4.248892320668627,
"density_atomic": 0.02311775759420327,
"volume": 129.77037187863948,
"volume_molar": 26.04984819769042,
"formula_full": "Ba1 In1 Br1",
"formula_reduced": "BaInBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-115548",
"created_at": "2022-09-04T14:38:46.944984Z",
"updated_at": "2022-09-04T14:38:46.945011Z",
"structure_string": "Ba1 In1 Br1\n1.0\n3.877847 -0.000000 0.000000\n-0.000000 3.877847 -0.000000\n0.000000 -0.000000 9.201877\nBa In Br\n1 1 1\ndirect\n0.000000 0.000000 0.404505 Ba\n0.000000 0.000000 0.031710 In\n0.000000 0.000000 0.732902 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"Br"
],
"chemical_system": "Ba-Br-In",
"density": 3.984680552479257,
"density_atomic": 0.021680210311391328,
"volume": 138.3750414276989,
"volume_molar": 27.77713257161447,
"formula_full": "Ba1 In1 Br1",
"formula_reduced": "BaInBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0612433333333332,
"spacegroup": 99
},
{
"id": "jvasp-115547",
"created_at": "2022-09-04T14:38:28.885772Z",
"updated_at": "2022-09-04T14:38:28.885795Z",
"structure_string": "Ba1 In1 Br1\n1.0\n6.009163 0.000000 0.000000\n-3.004582 5.204088 -0.000000\n-0.000000 0.000000 3.880541\nBa In Br\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666666 0.333334 0.000000 In\n0.333333 0.666667 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"Br"
],
"chemical_system": "Ba-Br-In",
"density": 4.543603040292872,
"density_atomic": 0.02472124633020737,
"volume": 121.35310493363927,
"volume_molar": 24.360182652447538,
"formula_full": "Ba1 In1 Br1",
"formula_reduced": "BaInBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0112866666666665,
"spacegroup": 187
},
{
"id": "jvasp-69071",
"created_at": "2022-09-04T14:36:11.740855Z",
"updated_at": "2022-09-04T14:36:11.740880Z",
"structure_string": "Ba1 In1 Br2\n1.0\n4.180430 0.000000 0.000000\n0.000000 4.180430 0.000000\n0.000000 -0.000000 7.604408\nBa In Br\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.729464 Br\n0.000000 0.000000 0.270536 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"In",
"Br"
],
"chemical_system": "Ba-Br-In",
"density": 5.147418106729607,
"density_atomic": 0.03009904178390332,
"volume": 132.89459607113346,
"volume_molar": 20.00774909459272,
"formula_full": "Ba1 In1 Br2",
"formula_reduced": "BaInBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-66049",
"created_at": "2022-09-04T14:36:00.932198Z",
"updated_at": "2022-09-04T14:36:00.932229Z",
"structure_string": "Ba1 In1 Cl1\n1.0\n-0.000000 3.925627 3.925627\n3.925627 -0.000000 3.925627\n3.925627 3.925627 0.000000\nBa In Cl\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"Cl"
],
"chemical_system": "Ba-Cl-In",
"density": 3.9470976182090687,
"density_atomic": 0.024795002877485393,
"volume": 120.99212146993094,
"volume_molar": 24.287719544764744,
"formula_full": "Ba1 In1 Cl1",
"formula_reduced": "BaInCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
}
]
}