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=id&page=62",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=60",
"results": [
{
"id": "jvasp-100836",
"created_at": "2022-09-04T14:36:50.906335Z",
"updated_at": "2022-09-04T14:36:50.906355Z",
"structure_string": "Dy1 Zn1 Cu1 As2\n1.0\n4.122225 -0.000000 0.000000\n-2.061112 3.569952 0.000000\n-0.000000 -0.000000 6.723745\nDy Zn Cu As\n1 1 1 2\ndirect\n0.000000 0.000000 0.016715 Dy\n0.333333 0.666666 0.624850 Zn\n0.666666 0.333333 0.354250 Cu\n0.666666 0.333333 0.752421 As\n0.333333 0.666666 0.251763 As\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Dy",
"Zn",
"Cu",
"As"
],
"chemical_system": "As-Cu-Dy-Zn",
"density": 7.405867700833885,
"density_atomic": 0.05053179206234215,
"volume": 98.94760893956409,
"volume_molar": 11.917528577989787,
"formula_full": "Dy1 Zn1 Cu1 As2",
"formula_reduced": "DyZnCuAs2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.72645017,
"spacegroup": 156
},
{
"id": "jvasp-100837",
"created_at": "2022-09-04T14:36:37.998996Z",
"updated_at": "2022-09-04T14:36:37.999023Z",
"structure_string": "Fe3 Si4 Ir1\n1.0\n4.574095 -0.006835 0.009537\n0.009503 4.574090 0.009537\n-0.006859 -0.006835 4.574099\nFe Si Ir\n3 4 1\ndirect\n0.136667 0.367365 0.633817 Fe\n0.633815 0.136668 0.367365 Fe\n0.367363 0.633817 0.136668 Fe\n0.172385 0.172385 0.172385 Si\n0.833243 0.644067 0.343480 Si\n0.343478 0.833245 0.644067 Si\n0.644065 0.343481 0.833245 Si\n0.868976 0.868980 0.868979 Ir\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Fe",
"Si",
"Ir"
],
"chemical_system": "Fe-Ir-Si",
"density": 8.191398873322168,
"density_atomic": 0.08359310993742569,
"volume": 95.70166735019747,
"volume_molar": 7.204111396869816,
"formula_full": "Fe3 Si4 Ir1",
"formula_reduced": "Fe3Si4Ir",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.94526525,
"spacegroup": 146
},
{
"id": "jvasp-100838",
"created_at": "2022-09-04T14:36:52.828788Z",
"updated_at": "2022-09-04T14:36:52.828822Z",
"structure_string": "Dy2 Al3 Co1\n1.0\n4.697063 -0.003396 2.574817\n1.523307 4.443191 2.574817\n-0.004757 -0.003396 5.356498\nDy Al Co\n2 3 1\ndirect\n0.626248 0.626246 0.626250 Dy\n0.373752 0.373751 0.373753 Dy\n0.000000 0.500000 0.000000 Al\n0.500000 -0.000000 0.000001 Al\n-0.000000 -0.000000 0.500001 Al\n0.000000 0.000000 0.000000 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Al",
"Co"
],
"chemical_system": "Al-Co-Dy",
"density": 6.898564976508679,
"density_atomic": 0.05361941789401249,
"volume": 111.89976011787329,
"volume_molar": 11.231268440667785,
"formula_full": "Dy2 Al3 Co1",
"formula_reduced": "Dy2Al3Co",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.9859053833333336,
"spacegroup": 166
},
{
"id": "jvasp-100839",
"created_at": "2022-09-04T14:36:54.394781Z",
"updated_at": "2022-09-04T14:36:54.394808Z",
"structure_string": "Dy1 Be1 Cu4\n1.0\n5.067433 -0.000000 0.000000\n-2.533717 4.388526 0.000000\n0.000000 0.000000 3.831668\nDy Be Cu\n1 1 4\ndirect\n0.333333 0.666667 -0.000000 Dy\n0.666666 0.333334 -0.000000 Be\n0.000000 0.000000 0.000000 Cu\n0.343564 0.171783 0.500000 Cu\n0.828217 0.171783 0.500000 Cu\n0.828217 0.656436 0.500000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Dy",
"density": 8.295723903740448,
"density_atomic": 0.07041362246234958,
"volume": 85.21078436503137,
"volume_molar": 8.552522295270437,
"formula_full": "Dy1 Be1 Cu4",
"formula_reduced": "DyBeCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2583624000000001,
"spacegroup": 187
},
{
"id": "jvasp-10084",
"created_at": "2022-09-04T14:38:02.633026Z",
"updated_at": "2022-09-04T14:38:02.633052Z",
"structure_string": "Rb8 Sn2 O8\n1.0\n6.795586 0.005210 0.057453\n2.713946 6.258800 0.018033\n1.904665 2.674371 9.628678\nRb Sn O\n8 2 8\ndirect\n0.741868 0.591603 0.164130 Rb\n0.258134 0.408397 0.835870 Rb\n0.764714 0.239397 0.967196 Rb\n0.235288 0.760603 0.032804 Rb\n0.278798 0.508041 0.440947 Rb\n0.721204 0.491959 0.559052 Rb\n0.789768 0.030109 0.376942 Rb\n0.210234 0.969891 0.623058 Rb\n0.277185 0.156066 0.247622 Sn\n0.722817 0.843934 0.752377 Sn\n0.871200 0.839677 0.904768 O\n0.128801 0.160323 0.095232 O\n0.036158 0.303208 0.374252 O\n0.963844 0.696792 0.625748 O\n0.466589 0.336383 0.188675 O\n0.533413 0.663617 0.811325 O\n0.454166 0.850742 0.353149 O\n0.545836 0.149258 0.646851 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"O"
],
"chemical_system": "O-Rb-Sn",
"density": 4.261688513974637,
"density_atomic": 0.04403159125715647,
"volume": 408.7973994597448,
"volume_molar": 13.676863788158505,
"formula_full": "Rb8 Sn2 O8",
"formula_reduced": "Rb4SnO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 0.6466306333333331,
"spacegroup": 2
},
{
"id": "jvasp-100840",
"created_at": "2022-09-04T14:36:39.219573Z",
"updated_at": "2022-09-04T14:36:39.219582Z",
"structure_string": "Er1 B1 Pt1 Rh2\n1.0\n4.220624 -0.000000 0.000000\n0.000000 4.220624 0.000000\n-0.000000 0.000000 4.206128\nEr B Pt Rh\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 0.500000 B\n0.500000 0.500000 -0.000000 Pt\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Er",
"B",
"Pt",
"Rh"
],
"chemical_system": "B-Er-Pt-Rh",
"density": 12.831150367212636,
"density_atomic": 0.06673200767817,
"volume": 74.92656333844496,
"volume_molar": 9.024366221743422,
"formula_full": "Er1 B1 Pt1 Rh2",
"formula_reduced": "ErBPtRh2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.860613996666667,
"spacegroup": 123
},
{
"id": "jvasp-100841",
"created_at": "2022-09-04T14:36:38.949813Z",
"updated_at": "2022-09-04T14:36:38.949842Z",
"structure_string": "Er1 Ag1 Sn2\n1.0\n4.636368 0.000000 0.000000\n0.000000 4.636368 0.000000\n0.000000 0.000000 4.344253\nEr Ag Sn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 -0.000000 Ag\n-0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Ag",
"Sn"
],
"chemical_system": "Ag-Er-Sn",
"density": 9.114063576451025,
"density_atomic": 0.04283404437440657,
"volume": 93.38366382208841,
"volume_molar": 14.059239205528401,
"formula_full": "Er1 Ag1 Sn2",
"formula_reduced": "ErAgSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.378215165,
"spacegroup": 123
},
{
"id": "jvasp-100842",
"created_at": "2022-09-04T14:36:57.786974Z",
"updated_at": "2022-09-04T14:36:57.787001Z",
"structure_string": "Er3 S3 O1 F1\n1.0\n3.684377 -0.002672 -10.101679\n-0.117510 3.682504 -10.101679\n0.002590 0.002672 10.752606\nEr S O F\n3 3 1 1\ndirect\n0.000000 0.000000 0.000000 Er\n0.686329 0.686328 -0.000000 Er\n0.313672 0.313671 -0.000000 Er\n0.500000 0.500000 -0.000000 S\n0.871224 0.871223 -0.000000 S\n0.128776 0.128776 -0.000000 S\n0.250000 0.749999 0.499999 O\n0.750001 0.250000 0.500000 F\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Er",
"S",
"O",
"F"
],
"chemical_system": "Er-F-O-S",
"density": 7.19497019273326,
"density_atomic": 0.054762957803757215,
"volume": 146.08414740248253,
"volume_molar": 10.996741230779229,
"formula_full": "Er3 S3 O1 F1",
"formula_reduced": "Er3S3OF",
"formula_anonymous": "ABC3D3",
"energy_above_hull": 1.3853917228125,
"spacegroup": 119
},
{
"id": "jvasp-100843",
"created_at": "2022-09-04T14:37:00.081793Z",
"updated_at": "2022-09-04T14:37:00.081819Z",
"structure_string": "La2 In3 Sn3\n1.0\n4.872715 0.000000 0.000000\n0.000000 4.806565 0.000000\n0.000000 0.000000 9.460766\nLa In Sn\n2 3 3\ndirect\n0.000000 0.000000 0.747086 La\n0.000000 0.000000 0.252914 La\n0.500000 0.500000 0.753270 In\n0.500000 0.500000 0.246730 In\n0.500000 -0.000000 -0.000000 In\n0.500000 -0.000000 0.500000 Sn\n-0.000000 0.500000 -0.000000 Sn\n-0.000000 0.500000 0.500000 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"La",
"In",
"Sn"
],
"chemical_system": "In-La-Sn",
"density": 7.332147011995966,
"density_atomic": 0.03610421075522914,
"volume": 221.58080270017598,
"volume_molar": 16.679884794678095,
"formula_full": "La2 In3 Sn3",
"formula_reduced": "La2(InSn)3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.44310812625,
"spacegroup": 47
},
{
"id": "jvasp-100844",
"created_at": "2022-09-04T14:37:00.526788Z",
"updated_at": "2022-09-04T14:37:00.526803Z",
"structure_string": "Co3 Re1 B4\n1.0\n3.033952 -0.000000 0.000000\n0.000000 4.103672 0.098894\n0.000000 -0.004848 5.465341\nCo Re B\n3 1 4\ndirect\n-0.000000 0.872047 0.827219 Co\n0.500000 0.374467 0.681496 Co\n0.500000 0.123631 0.170972 Co\n-0.000000 0.627665 0.320785 Re\n-0.000000 0.127171 0.481023 B\n-0.000000 0.367712 0.956116 B\n0.500000 0.901444 0.547382 B\n0.500000 0.605860 0.015002 B\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Co",
"Re",
"B"
],
"chemical_system": "B-Co-Re",
"density": 9.913686985651175,
"density_atomic": 0.11756609482554337,
"volume": 68.04682941856001,
"volume_molar": 5.122344812878467,
"formula_full": "Co3 Re1 B4",
"formula_reduced": "Co3ReB4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 5.021031379166667,
"spacegroup": 6
},
{
"id": "jvasp-100845",
"created_at": "2022-09-04T14:36:37.629107Z",
"updated_at": "2022-09-04T14:36:37.629132Z",
"structure_string": "Ce1 Co1 Si3\n1.0\n3.735163 0.009417 -4.389151\n-0.498469 3.701764 -4.389151\n-0.008213 -0.009417 5.763335\nCe Co Si\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ce\n0.250000 0.749999 0.499999 Co\n0.619803 0.619803 -0.000000 Si\n0.380196 0.380196 -0.000000 Si\n0.750000 0.250000 0.500000 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Co",
"Si"
],
"chemical_system": "Ce-Co-Si",
"density": 5.9244302117921475,
"density_atomic": 0.06296688224099835,
"volume": 79.40682184109238,
"volume_molar": 9.563981168626013,
"formula_full": "Ce1 Co1 Si3",
"formula_reduced": "CeCoSi3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.0799384399999994,
"spacegroup": 119
},
{
"id": "jvasp-100846",
"created_at": "2022-09-04T14:36:40.714893Z",
"updated_at": "2022-09-04T14:36:40.714905Z",
"structure_string": "Ce1 Al2 Cu3\n1.0\n5.158943 0.011480 0.000000\n-2.424398 4.553803 0.000000\n0.000000 0.000000 4.179012\nCe Al Cu\n1 2 3\ndirect\n0.499999 0.500000 -0.000000 Ce\n-0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.162055 0.837944 -0.000000 Cu\n0.837943 0.162056 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Al",
"Cu"
],
"chemical_system": "Al-Ce-Cu",
"density": 6.499317726798618,
"density_atomic": 0.061041958147217454,
"volume": 98.29304599845156,
"volume_molar": 9.865575978863834,
"formula_full": "Ce1 Al2 Cu3",
"formula_reduced": "CeAl2Cu3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.7301254083333335,
"spacegroup": 65
}
]
}