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=-nsites&page=4542",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=4540",
"results": [
{
"id": "jvasp-16281",
"created_at": "2022-09-04T14:37:50.856819Z",
"updated_at": "2022-09-04T14:37:50.856846Z",
"structure_string": "Cu1 F1\n1.0\n2.958284 -0.000000 1.707967\n0.986095 2.789097 1.707967\n0.000000 -0.000000 3.415933\nCu F\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"F"
],
"chemical_system": "Cu-F",
"density": 4.8632198423495705,
"density_atomic": 0.07096058197092904,
"volume": 28.184661743886984,
"volume_molar": 8.486600014733725,
"formula_full": "Cu1 F1",
"formula_reduced": "CuF",
"formula_anonymous": "AB",
"energy_above_hull": 0.0762999999999999,
"spacegroup": 216
},
{
"id": "jvasp-4711",
"created_at": "2022-09-04T14:38:01.183499Z",
"updated_at": "2022-09-04T14:38:01.183523Z",
"structure_string": "Pd1 O1\n1.0\n2.877278 -0.000000 -1.394273\n-0.675637 2.796828 -1.394273\n-0.237861 -0.302164 3.175112\nPd O\n1 1\ndirect\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.000001 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pd",
"O"
],
"chemical_system": "O-Pd",
"density": 8.7899974074249,
"density_atomic": 0.08648074028436814,
"volume": 23.126536537771877,
"volume_molar": 6.963562916087265,
"formula_full": "Pd1 O1",
"formula_reduced": "PdO",
"formula_anonymous": "AB",
"energy_above_hull": 1.2817946000000002,
"spacegroup": 225
},
{
"id": "jvasp-996",
"created_at": "2022-09-04T14:38:00.335561Z",
"updated_at": "2022-09-04T14:38:00.335587Z",
"structure_string": "Sc2\n1.0\n1.645701 -2.850437 0.000000\n1.645701 2.850437 0.000000\n0.000000 0.000000 5.101643\nSc\n2\ndirect\n0.333333 0.666667 0.250000 Sc\n0.666667 0.333333 0.750000 Sc\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Sc"
],
"chemical_system": "Sc",
"density": 3.119345396262059,
"density_atomic": 0.04178568785756107,
"volume": 47.86327813526952,
"volume_molar": 14.411969908281167,
"formula_full": "Sc2",
"formula_reduced": "Sc",
"formula_anonymous": "A",
"energy_above_hull": 1.0000000000065512e-05,
"spacegroup": 194
},
{
"id": "jvasp-20417",
"created_at": "2022-09-04T14:37:39.254119Z",
"updated_at": "2022-09-04T14:37:39.254138Z",
"structure_string": "Sm1 Zn1\n1.0\n3.617703 0.000000 -0.000000\n-0.000000 3.617703 -0.000000\n-0.000000 0.000000 3.617703\nSm Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"Zn"
],
"chemical_system": "Sm-Zn",
"density": 7.567273246862536,
"density_atomic": 0.04224071546676014,
"volume": 47.347682867110294,
"volume_molar": 14.256720544278929,
"formula_full": "Sm1 Zn1",
"formula_reduced": "SmZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.53587655,
"spacegroup": 221
},
{
"id": "jvasp-39085",
"created_at": "2022-09-04T14:37:50.679207Z",
"updated_at": "2022-09-04T14:37:50.679229Z",
"structure_string": "Sm1 Br1\n1.0\n1.823667 -3.158685 0.000000\n1.823667 3.158685 -0.000000\n0.000000 0.000000 4.574818\nSm Br\n1 1\ndirect\n0.333334 0.666668 0.000000 Sm\n0.666668 0.333334 0.500000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"Br"
],
"chemical_system": "Br-Sm",
"density": 7.25470016411179,
"density_atomic": 0.037946726865662216,
"volume": 52.705468038925616,
"volume_molar": 15.86998736760456,
"formula_full": "Sm1 Br1",
"formula_reduced": "SmBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-117494",
"created_at": "2022-09-04T14:38:45.422754Z",
"updated_at": "2022-09-04T14:38:45.422778Z",
"structure_string": "B1 I1\n1.0\n4.352420 -0.000000 0.000000\n-2.176210 3.769307 -0.000000\n-0.000000 0.000000 3.806660\nB I\n1 1\ndirect\n0.000000 0.000000 0.000000 B\n0.333333 0.666667 0.000000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"B",
"I"
],
"chemical_system": "B-I",
"density": 3.661806819909793,
"density_atomic": 0.03202532890901133,
"volume": 62.45056860094378,
"volume_molar": 18.804305732845986,
"formula_full": "B1 I1",
"formula_reduced": "BI",
"formula_anonymous": "AB",
"energy_above_hull": 2.283799429166667,
"spacegroup": 187
},
{
"id": "jvasp-1038",
"created_at": "2022-09-04T14:38:33.341905Z",
"updated_at": "2022-09-04T14:38:33.341934Z",
"structure_string": "U2\n1.0\n2.807465 0.000000 0.000000\n-1.403732 2.958954 0.000000\n0.000000 0.000000 4.904591\nU\n2\ndirect\n0.096884 0.193769 0.750000 U\n0.903117 0.806230 0.250000 U\n",
"nsites": 2,
"nelements": 1,
"elements": [
"U"
],
"chemical_system": "U",
"density": 19.402310022811776,
"density_atomic": 0.04908792048281443,
"volume": 40.74322114949228,
"volume_molar": 12.268070638902575,
"formula_full": "U2",
"formula_reduced": "U",
"formula_anonymous": "A",
"energy_above_hull": 9.999999999621425e-06,
"spacegroup": 63
},
{
"id": "jvasp-120210",
"created_at": "2022-09-04T14:38:45.389989Z",
"updated_at": "2022-09-04T14:38:45.390015Z",
"structure_string": "H1 Cl1\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 10.583545\nH Cl\n1 1\ndirect\n0.000000 0.000000 0.938605 H\n0.000000 0.000000 0.061395 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"H",
"Cl"
],
"chemical_system": "Cl-H",
"density": 0.10422873213748063,
"density_atomic": 0.0034430275049691906,
"volume": 580.8841193146079,
"volume_molar": 174.90829658806018,
"formula_full": "H1 Cl1",
"formula_reduced": "HCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.7464670337500001,
"spacegroup": 99
},
{
"id": "jvasp-115146",
"created_at": "2022-09-04T14:38:44.789315Z",
"updated_at": "2022-09-04T14:38:44.789348Z",
"structure_string": "In1 I1\n1.0\n4.749562 0.000000 -0.000000\n0.000000 4.749562 0.000000\n0.000000 0.000000 4.289494\nIn I\n1 1\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.000000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"In",
"I"
],
"chemical_system": "I-In",
"density": 4.148135493619873,
"density_atomic": 0.020668873557980555,
"volume": 96.7638606133797,
"volume_molar": 29.13627945473963,
"formula_full": "In1 I1",
"formula_reduced": "InI",
"formula_anonymous": "AB",
"energy_above_hull": 0.11371,
"spacegroup": 123
},
{
"id": "jvasp-113470",
"created_at": "2022-09-04T14:38:45.019427Z",
"updated_at": "2022-09-04T14:38:45.019457Z",
"structure_string": "S2\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 9.525190\nS\n2\ndirect\n0.000000 0.000000 0.865214 S\n0.000000 0.000000 0.134786 S\n",
"nsites": 2,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 0.20369405185828615,
"density_atomic": 0.003825586317446597,
"volume": 522.7956799403518,
"volume_molar": 157.41745866603534,
"formula_full": "S2",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy_above_hull": 1.9087,
"spacegroup": 123
},
{
"id": "jvasp-115228",
"created_at": "2022-09-04T14:38:45.753359Z",
"updated_at": "2022-09-04T14:38:45.753385Z",
"structure_string": "Mg1 O1\n1.0\n5.291772 0.000000 0.000000\n0.000000 5.291772 0.000000\n0.000000 0.000000 7.408481\nMg O\n1 1\ndirect\n0.000000 0.000000 0.862108 Mg\n0.000000 0.000000 0.137892 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 0.322604289996484,
"density_atomic": 0.009640478185062007,
"volume": 207.45858883836436,
"volume_molar": 62.46724119277975,
"formula_full": "Mg1 O1",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 1.947705,
"spacegroup": 99
},
{
"id": "jvasp-110522",
"created_at": "2022-09-04T14:38:38.925393Z",
"updated_at": "2022-09-04T14:38:38.925405Z",
"structure_string": "Y1 Ho1\n1.0\n3.587821 0.000000 -0.000000\n-1.793912 3.107143 -0.000000\n-0.000000 0.000000 5.592073\nY Ho\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.333333 0.666666 0.500000 Ho\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Ho"
],
"chemical_system": "Ho-Y",
"density": 6.761417648489398,
"density_atomic": 0.032082274823499506,
"volume": 62.33971908173567,
"volume_molar": 18.770928162453508,
"formula_full": "Y1 Ho1",
"formula_reduced": "YHo",
"formula_anonymous": "AB",
"energy_above_hull": 1.4379905083333333,
"spacegroup": 187
}
]
}