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=nelements&page=610",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=608",
"results": [
{
"id": "jvasp-106237",
"created_at": "2022-09-04T14:38:39.229394Z",
"updated_at": "2022-09-04T14:38:39.229427Z",
"structure_string": "Co6 Sn2\n1.0\n5.323072 0.000000 -0.000000\n-2.661536 4.609917 -0.000000\n-0.000000 -0.000000 4.223575\nCo Sn\n6 2\ndirect\n0.157085 0.314172 0.250000 Co\n0.685828 0.842915 0.250000 Co\n0.157085 0.842915 0.250000 Co\n0.842914 0.685829 0.749999 Co\n0.314171 0.157085 0.749999 Co\n0.842914 0.157085 0.749999 Co\n0.333333 0.666667 0.749999 Sn\n0.666667 0.333333 0.250000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Co",
"Sn"
],
"chemical_system": "Co-Sn",
"density": 9.469237470053011,
"density_atomic": 0.07718880719788791,
"volume": 103.64196948257676,
"volume_molar": 7.8018316108462695,
"formula_full": "Co6 Sn2",
"formula_reduced": "Co3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 2.5917286,
"spacegroup": 194
},
{
"id": "jvasp-112464",
"created_at": "2022-09-04T14:38:40.392811Z",
"updated_at": "2022-09-04T14:38:40.392827Z",
"structure_string": "Lu8 Au4\n1.0\n4.812178 -0.000000 0.000000\n0.000000 6.923255 0.000000\n-0.000000 -0.000000 8.696563\nLu Au\n8 4\ndirect\n0.250000 0.850222 0.922177 Lu\n0.250000 0.350221 0.577822 Lu\n0.750000 0.149779 0.077823 Lu\n0.750000 0.649779 0.422177 Lu\n0.250000 0.485194 0.178167 Lu\n0.250000 0.985194 0.321833 Lu\n0.750000 0.514807 0.821833 Lu\n0.750000 0.014807 0.678166 Lu\n0.250000 0.258345 0.899699 Au\n0.250000 0.758345 0.600301 Au\n0.750000 0.741656 0.100301 Au\n0.750000 0.241656 0.399699 Au\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Lu",
"Au"
],
"chemical_system": "Au-Lu",
"density": 12.537698018629573,
"density_atomic": 0.04141728126487992,
"volume": 289.7341311047253,
"volume_molar": 14.540164337407917,
"formula_full": "Lu8 Au4",
"formula_reduced": "Lu2Au",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6769430233333336,
"spacegroup": 62
},
{
"id": "jvasp-29657",
"created_at": "2022-09-04T14:38:34.049267Z",
"updated_at": "2022-09-04T14:38:34.049286Z",
"structure_string": "Fe1 Cl2\n1.0\n3.390981 -0.000000 0.000000\n-1.695490 2.936675 0.000000\n0.000000 -0.000000 5.428146\nFe Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.666667 0.333334 0.775347 Cl\n0.333333 0.666668 0.224653 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Fe",
"Cl"
],
"chemical_system": "Cl-Fe",
"density": 3.8937469971427983,
"density_atomic": 0.05549942606068106,
"volume": 54.05461304626662,
"volume_molar": 10.850816283064999,
"formula_full": "Fe1 Cl2",
"formula_reduced": "FeCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9010312116666664,
"spacegroup": 164
},
{
"id": "jvasp-19780",
"created_at": "2022-09-04T14:38:31.950949Z",
"updated_at": "2022-09-04T14:38:31.950974Z",
"structure_string": "Si2 W1\n1.0\n3.040496 0.000000 -1.148863\n-0.434102 3.009347 -1.148863\n-0.010274 -0.011862 4.570618\nSi W\n2 1\ndirect\n0.335307 0.335306 0.670612 Si\n0.664696 0.664696 0.329391 Si\n0.000000 0.000000 0.000000 W\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Si",
"W"
],
"chemical_system": "Si-W",
"density": 9.548827842166197,
"density_atomic": 0.07187718735191828,
"volume": 41.737860238070866,
"volume_molar": 8.378375645828996,
"formula_full": "Si2 W1",
"formula_reduced": "Si2W",
"formula_anonymous": "AB2",
"energy_above_hull": 4.186029066666666,
"spacegroup": 139
},
{
"id": "jvasp-110470",
"created_at": "2022-09-04T14:38:39.204622Z",
"updated_at": "2022-09-04T14:38:39.204647Z",
"structure_string": "Sr1 Ca3\n1.0\n5.582366 -0.000000 -0.000000\n-0.000000 5.582366 -0.000000\n0.000000 -0.000000 5.582366\nSr Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Ca"
],
"chemical_system": "Ca-Sr",
"density": 1.9840497737915002,
"density_atomic": 0.022993499315380268,
"volume": 173.96221189022825,
"volume_molar": 26.190623173097507,
"formula_full": "Sr1 Ca3",
"formula_reduced": "SrCa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-57879",
"created_at": "2022-09-04T14:38:31.292464Z",
"updated_at": "2022-09-04T14:38:31.292489Z",
"structure_string": "Co4 Sb8\n1.0\n0.000000 6.548634 -0.032198\n6.431256 0.000000 0.000000\n0.000000 -2.983794 -5.864491\nCo Sb\n4 8\ndirect\n0.267825 0.000423 0.278629 Co\n0.732174 0.500424 0.221371 Co\n0.732175 0.999577 0.721371 Co\n0.267826 0.499577 0.778629 Co\n0.349175 0.644146 0.163919 Sb\n0.650825 0.144146 0.336081 Sb\n0.650825 0.355855 0.836081 Sb\n0.349175 0.855855 0.663919 Sb\n0.146544 0.358903 0.367814 Sb\n0.853455 0.858903 0.132186 Sb\n0.853456 0.641098 0.632186 Sb\n0.146545 0.141098 0.867814 Sb\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Co",
"Sb"
],
"chemical_system": "Co-Sb",
"density": 8.113446072481771,
"density_atomic": 0.04846400876741224,
"volume": 247.60642598903084,
"volume_molar": 12.426006253220548,
"formula_full": "Co4 Sb8",
"formula_reduced": "CoSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8737910333333336,
"spacegroup": 14
},
{
"id": "jvasp-110617",
"created_at": "2022-09-04T14:38:39.197636Z",
"updated_at": "2022-09-04T14:38:39.197657Z",
"structure_string": "Al2 F6\n1.0\n4.724070 -0.070839 -8.270064\n0.023178 3.628855 -0.020161\n0.000187 0.030691 5.928065\nAl F\n2 6\ndirect\n0.558367 0.305707 0.038025 Al\n0.827345 0.305725 0.844473 Al\n0.192865 0.305714 0.441247 F\n0.692871 0.305711 0.941272 F\n0.830699 0.805722 0.854365 F\n0.555007 0.805712 0.028131 F\n0.915171 0.305512 0.663365 F\n0.470543 0.305927 0.219134 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Al",
"F"
],
"chemical_system": "Al-F",
"density": 2.7440140004268394,
"density_atomic": 0.07871149535028915,
"volume": 101.63699678678016,
"volume_molar": 7.650903763420722,
"formula_full": "Al2 F6",
"formula_reduced": "AlF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0156924999999998,
"spacegroup": 65
},
{
"id": "jvasp-118501",
"created_at": "2022-09-04T14:38:34.211642Z",
"updated_at": "2022-09-04T14:38:34.211676Z",
"structure_string": "H2 S1\n1.0\n3.770616 0.209849 -0.301589\n0.118747 -2.373086 -0.163781\n1.140109 -2.072196 -3.820759\nH S\n2 1\ndirect\n0.586119 0.773487 0.480883 H\n0.377772 0.565649 0.689029 H\n0.981931 0.169624 0.084895 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 1.7562968039659017,
"density_atomic": 0.09310205522987543,
"volume": 32.222704349466746,
"volume_molar": 6.468322042011766,
"formula_full": "H2 S1",
"formula_reduced": "H2S",
"formula_anonymous": "AB2",
"energy_above_hull": 2.21794,
"spacegroup": 65
},
{
"id": "jvasp-21485",
"created_at": "2022-09-04T14:38:33.995744Z",
"updated_at": "2022-09-04T14:38:33.995771Z",
"structure_string": "Sm4 F12\n1.0\n4.411761 -0.000000 0.000000\n0.000000 6.666662 0.000000\n0.000000 0.000000 7.059944\nSm F\n4 12\ndirect\n0.934743 0.631754 0.750000 Sm\n0.434743 0.868245 0.250000 Sm\n0.565257 0.131754 0.750000 Sm\n0.065257 0.368245 0.250000 Sm\n0.076595 0.981073 0.750000 F\n0.576595 0.518927 0.250000 F\n0.423405 0.481073 0.750000 F\n0.923405 0.018927 0.250000 F\n0.391588 0.165539 0.064446 F\n0.891587 0.334461 0.935553 F\n0.108412 0.665539 0.435554 F\n0.608412 0.834460 0.564446 F\n0.608412 0.834460 0.935553 F\n0.108412 0.665539 0.064446 F\n0.891587 0.334461 0.564446 F\n0.391588 0.165539 0.435554 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sm",
"F"
],
"chemical_system": "F-Sm",
"density": 6.63288350141079,
"density_atomic": 0.07705455422323043,
"volume": 207.64509199089383,
"volume_molar": 7.815424825576945,
"formula_full": "Sm4 F12",
"formula_reduced": "SmF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-59699",
"created_at": "2022-09-04T14:38:33.638193Z",
"updated_at": "2022-09-04T14:38:33.638217Z",
"structure_string": "Mo6 Se8\n1.0\n6.731523 -0.016237 -0.201387\n-0.207016 6.728358 -0.201387\n-0.015783 -0.016237 6.734516\nMo Se\n6 8\ndirect\n0.585981 0.453772 0.772031 Mo\n0.453772 0.772031 0.585981 Mo\n0.772030 0.585981 0.453772 Mo\n0.414018 0.546228 0.227969 Mo\n0.546228 0.227969 0.414018 Mo\n0.227969 0.414018 0.546228 Mo\n0.873918 0.255903 0.618835 Se\n0.255904 0.618835 0.873919 Se\n0.618835 0.873919 0.255903 Se\n0.126081 0.744096 0.381165 Se\n0.744096 0.381164 0.126081 Se\n0.381165 0.126081 0.744096 Se\n0.214952 0.214952 0.214952 Se\n0.785048 0.785048 0.785048 Se\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mo",
"Se"
],
"chemical_system": "Mo-Se",
"density": 6.574121816878083,
"density_atomic": 0.04590862551405729,
"volume": 304.95358646085316,
"volume_molar": 13.117667306672057,
"formula_full": "Mo6 Se8",
"formula_reduced": "Mo3Se4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.761425880952381,
"spacegroup": 148
},
{
"id": "jvasp-20115",
"created_at": "2022-09-04T14:38:33.641338Z",
"updated_at": "2022-09-04T14:38:33.641366Z",
"structure_string": "Ni6 S8\n1.0\n5.800999 -0.000000 3.349209\n1.933666 5.469235 3.349209\n0.000000 0.000000 6.698417\nNi S\n6 8\ndirect\n0.500000 -0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 -0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.125000 0.125000 0.125000 Ni\n0.875000 0.875001 0.875000 Ni\n0.741717 0.741718 0.741717 S\n0.258283 0.258283 0.725152 S\n0.258283 0.725152 0.258283 S\n0.725152 0.258283 0.258283 S\n0.741717 0.274848 0.741717 S\n0.274848 0.741718 0.741717 S\n0.258283 0.258283 0.258283 S\n0.741717 0.741718 0.274848 S\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ni",
"S"
],
"chemical_system": "Ni-S",
"density": 4.755945392496152,
"density_atomic": 0.06587588766540893,
"volume": 212.5208554472553,
"volume_molar": 9.141646470992743,
"formula_full": "Ni6 S8",
"formula_reduced": "Ni3S4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.6774267428571428,
"spacegroup": 227
},
{
"id": "jvasp-110755",
"created_at": "2022-09-04T14:38:39.180482Z",
"updated_at": "2022-09-04T14:38:39.180515Z",
"structure_string": "Ca3 Y1\n1.0\n5.324466 -0.000000 0.000000\n0.000000 5.324466 0.000000\n-0.000000 -0.000000 5.324466\nCa Y\n3 1\ndirect\n-0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.500000 -0.000000 Ca\n0.000000 0.000000 0.000000 Y\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Y"
],
"chemical_system": "Ca-Y",
"density": 2.30068793614535,
"density_atomic": 0.026499142274586506,
"volume": 150.94828196896484,
"volume_molar": 22.7257950374319,
"formula_full": "Ca3 Y1",
"formula_reduced": "Ca3Y",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4288741775,
"spacegroup": 221
}
]
}