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_anonymous&page=412",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=410",
"results": [
{
"id": "jvasp-16804",
"created_at": "2022-09-04T14:38:32.559435Z",
"updated_at": "2022-09-04T14:38:32.559446Z",
"structure_string": "Mn1 Au1\n1.0\n3.199196 0.000000 0.000000\n0.000000 3.199196 -0.000000\n-0.000000 0.000000 3.214297\nMn Au\n1 1\ndirect\n0.500001 0.500001 0.500000 Mn\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Au"
],
"chemical_system": "Au-Mn",
"density": 12.71503384664676,
"density_atomic": 0.060794220799093905,
"volume": 32.897863871129815,
"volume_molar": 9.905778346763112,
"formula_full": "Mn1 Au1",
"formula_reduced": "MnAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.592522405689655,
"spacegroup": 221
},
{
"id": "jvasp-16825",
"created_at": "2022-09-04T14:38:31.921830Z",
"updated_at": "2022-09-04T14:38:31.921856Z",
"structure_string": "Pu2 Ni2\n1.0\n2.794790 0.000000 -0.982694\n0.000000 3.451842 0.000000\n0.595863 -0.000000 6.160196\nPu Ni\n2 2\ndirect\n0.199497 0.749999 0.398995 Pu\n0.800502 0.250000 0.601006 Pu\n0.436096 0.749999 0.872196 Ni\n0.563903 0.250000 0.127805 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pu",
"Ni"
],
"chemical_system": "Ni-Pu",
"density": 16.3592056955786,
"density_atomic": 0.06509388011407818,
"volume": 61.44970914300897,
"volume_molar": 9.251469953006474,
"formula_full": "Pu2 Ni2",
"formula_reduced": "PuNi",
"formula_anonymous": "AB",
"energy_above_hull": 3.1264212,
"spacegroup": 63
},
{
"id": "jvasp-116271",
"created_at": "2022-09-04T14:38:42.310336Z",
"updated_at": "2022-09-04T14:38:42.310360Z",
"structure_string": "Li2 H2\n1.0\n3.975382 -0.226086 -0.373735\n-0.171359 -3.955297 0.570059\n-0.115442 1.701809 -2.258146\nLi H\n2 2\ndirect\n0.974338 0.124189 0.866716 Li\n0.474268 0.624171 0.866722 Li\n0.974308 0.624092 0.866544 H\n0.474247 0.124113 0.866539 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"H"
],
"chemical_system": "H-Li",
"density": 0.8241453686506276,
"density_atomic": 0.12487500014923546,
"volume": 32.03203199375123,
"volume_molar": 4.822535137379834,
"formula_full": "Li2 H2",
"formula_reduced": "LiH",
"formula_anonymous": "AB",
"energy_above_hull": 0.821115,
"spacegroup": 225
},
{
"id": "jvasp-114454",
"created_at": "2022-09-04T14:38:41.735528Z",
"updated_at": "2022-09-04T14:38:41.735554Z",
"structure_string": "N1 F1\n1.0\n3.303176 -0.000000 -0.000000\n-1.651588 2.860635 0.000000\n-0.000000 0.000000 2.072720\nN F\n1 1\ndirect\n0.000000 0.000000 0.000000 N\n0.333333 0.666667 0.000000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"N",
"F"
],
"chemical_system": "F-N",
"density": 2.7983072144177767,
"density_atomic": 0.1021163293364341,
"volume": 19.585506186877986,
"volume_molar": 5.897333755661505,
"formula_full": "N1 F1",
"formula_reduced": "NF",
"formula_anonymous": "AB",
"energy_above_hull": 2.77261176625,
"spacegroup": 187
},
{
"id": "jvasp-114527",
"created_at": "2022-09-04T14:38:42.026385Z",
"updated_at": "2022-09-04T14:38:42.026407Z",
"structure_string": "Ba1 Ag1\n1.0\n5.525252 -0.000000 0.000000\n-2.762626 4.785009 0.000000\n-0.000000 -0.000000 3.846963\nBa Ag\n1 1\ndirect\n0.333333 0.666666 0.000000 Ba\n0.666667 0.333333 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Ag"
],
"chemical_system": "Ag-Ba",
"density": 4.0032084325385515,
"density_atomic": 0.019664238680608178,
"volume": 101.70747174525974,
"volume_molar": 30.62483555968385,
"formula_full": "Ba1 Ag1",
"formula_reduced": "BaAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.349135,
"spacegroup": 187
},
{
"id": "jvasp-116270",
"created_at": "2022-09-04T14:38:42.013876Z",
"updated_at": "2022-09-04T14:38:42.013905Z",
"structure_string": "Li2 H2\n1.0\n3.913426 -0.211062 0.799352\n-0.136536 -2.825892 -0.077844\n0.432521 -2.773073 -2.849765\nLi H\n2 2\ndirect\n0.995795 0.968588 0.871863 Li\n0.495794 0.968596 0.371843 Li\n0.995859 -0.031405 0.371815 H\n0.495858 -0.031528 0.871910 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"H"
],
"chemical_system": "H-Li",
"density": 0.8239548451299145,
"density_atomic": 0.12484613191120064,
"volume": 32.039438777687415,
"volume_molar": 4.823650254765899,
"formula_full": "Li2 H2",
"formula_reduced": "LiH",
"formula_anonymous": "AB",
"energy_above_hull": 0.8210249999999999,
"spacegroup": 225
},
{
"id": "jvasp-111037",
"created_at": "2022-09-04T14:38:37.560772Z",
"updated_at": "2022-09-04T14:38:37.560795Z",
"structure_string": "La1 Ce1\n1.0\n3.362108 -0.006351 5.137922\n1.526929 2.995380 5.137922\n-0.010388 -0.006351 6.140187\nLa Ce\n1 1\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Ce\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Ce"
],
"chemical_system": "Ce-La",
"density": 7.4590236782798645,
"density_atomic": 0.03219773054618158,
"volume": 62.116179186336645,
"volume_molar": 18.703618726675074,
"formula_full": "La1 Ce1",
"formula_reduced": "LaCe",
"formula_anonymous": "AB",
"energy_above_hull": 1.3537502500000005,
"spacegroup": 166
},
{
"id": "jvasp-114456",
"created_at": "2022-09-04T14:38:42.010291Z",
"updated_at": "2022-09-04T14:38:42.010317Z",
"structure_string": "N2 F2\n1.0\n2.152360 0.000000 -0.000000\n0.000000 2.152360 -0.000000\n-0.000000 0.000000 7.862747\nN F\n2 2\ndirect\n0.000000 0.000000 0.000115 N\n0.500000 0.500000 -0.000115 N\n0.000000 0.000000 0.336662 F\n0.500000 0.500000 0.663338 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"N",
"F"
],
"chemical_system": "F-N",
"density": 3.0092347046205883,
"density_atomic": 0.10981353318334598,
"volume": 36.42538295641169,
"volume_molar": 5.483969585010404,
"formula_full": "N2 F2",
"formula_reduced": "NF",
"formula_anonymous": "AB",
"energy_above_hull": 2.50327176625,
"spacegroup": 129
},
{
"id": "jvasp-118575",
"created_at": "2022-09-04T14:38:35.093726Z",
"updated_at": "2022-09-04T14:38:35.093754Z",
"structure_string": "K2 Se2\n1.0\n4.670766 0.000000 0.000000\n0.000000 4.670766 0.000000\n0.000000 0.000000 6.611166\nK Se\n2 2\ndirect\n-0.000000 0.000000 0.250337 K\n0.500001 0.500001 0.749666 K\n-0.000000 0.000000 0.750542 Se\n0.500001 0.500001 0.249457 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Se"
],
"chemical_system": "K-Se",
"density": 2.71844991541823,
"density_atomic": 0.027733565611763177,
"volume": 144.22956124701838,
"volume_molar": 21.714267989564643,
"formula_full": "K2 Se2",
"formula_reduced": "KSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2813183416666666,
"spacegroup": 225
},
{
"id": "jvasp-19728",
"created_at": "2022-09-04T14:38:31.873776Z",
"updated_at": "2022-09-04T14:38:31.873798Z",
"structure_string": "Zn1 Ni1\n1.0\n2.890395 -0.000000 0.000000\n-0.000000 2.890395 0.000000\n-0.000000 -0.000000 2.890395\nZn Ni\n1 1\ndirect\n0.500001 0.500001 0.500001 Zn\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zn",
"Ni"
],
"chemical_system": "Ni-Zn",
"density": 8.534099183679217,
"density_atomic": 0.08282442009449914,
"volume": 24.147467591298376,
"volume_molar": 7.270972441616848,
"formula_full": "Zn1 Ni1",
"formula_reduced": "ZnNi",
"formula_anonymous": "AB",
"energy_above_hull": 0.3410758000000001,
"spacegroup": 221
},
{
"id": "jvasp-114556",
"created_at": "2022-09-04T14:38:42.285260Z",
"updated_at": "2022-09-04T14:38:42.285294Z",
"structure_string": "Ba2 Cl2\n1.0\n4.275398 -0.000000 -0.000000\n-0.000000 4.275398 0.000000\n-0.000000 -0.000000 8.253351\nBa Cl\n2 2\ndirect\n0.000000 0.000000 0.765417 Ba\n0.500000 0.500000 0.234582 Ba\n0.000000 0.000000 0.370022 Cl\n0.500000 0.500000 0.629978 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.8035501607638085,
"density_atomic": 0.026514080870188608,
"volume": 150.86323450485673,
"volume_molar": 22.712990842428404,
"formula_full": "Ba2 Cl2",
"formula_reduced": "BaCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-51076",
"created_at": "2022-09-04T14:38:34.310883Z",
"updated_at": "2022-09-04T14:38:34.310899Z",
"structure_string": "In4 S4\n1.0\n0.000000 4.003871 0.072646\n10.826488 0.000000 0.000000\n0.000000 -3.920567 -4.560905\nIn S\n4 4\ndirect\n0.880729 0.120017 0.880902 In\n0.880729 0.379983 0.380902 In\n0.119270 0.879983 0.119098 In\n0.119270 0.620017 0.619099 In\n0.981684 0.651702 -0.018296 S\n0.018315 0.151702 0.518296 S\n0.018314 0.348299 0.018296 S\n0.981685 0.848299 0.481704 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"In",
"S"
],
"chemical_system": "In-S",
"density": 5.012897320448182,
"density_atomic": 0.04110533321023977,
"volume": 194.62194745102116,
"volume_molar": 14.650509531692158,
"formula_full": "In4 S4",
"formula_reduced": "InS",
"formula_anonymous": "AB",
"energy_above_hull": 0.1790599849999999,
"spacegroup": 58
}
]
}