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=-energy_above_hull&page=3390",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=3388",
"results": [
{
"id": "jvasp-101393",
"created_at": "2022-09-04T14:36:32.296840Z",
"updated_at": "2022-09-04T14:36:32.296866Z",
"structure_string": "Ce1 Pb1 Au2\n1.0\n4.431025 0.000000 2.558254\n1.477008 4.177610 2.558254\n-0.000000 -0.000000 5.116507\nCe Pb Au\n1 1 2\ndirect\n0.500001 0.500000 0.499999 Ce\n0.000000 0.000000 0.000000 Pb\n0.250000 0.250000 0.250000 Au\n0.750001 0.750000 0.749999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Pb",
"Au"
],
"chemical_system": "Au-Ce-Pb",
"density": 12.995938029473356,
"density_atomic": 0.04223323259973719,
"volume": 94.71214382071457,
"volume_molar": 14.259246544242686,
"formula_full": "Ce1 Pb1 Au2",
"formula_reduced": "CePbAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.668405365,
"spacegroup": 225
},
{
"id": "jvasp-119974",
"created_at": "2022-09-04T14:38:49.480124Z",
"updated_at": "2022-09-04T14:38:49.480151Z",
"structure_string": "Be1 Te1 Br1\n1.0\n3.218181 1.461597 0.000000\n0.211539 7.998379 0.000000\n0.000000 0.000000 3.567079\nBe Te Br\n1 1 1\ndirect\n-0.081010 0.117998 0.000000 Be\n0.190742 0.348462 0.000000 Te\n0.191726 -0.156612 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Te",
"Br"
],
"chemical_system": "Be-Br-Te",
"density": 3.9633506455126564,
"density_atomic": 0.033070769015447955,
"volume": 90.71455213510897,
"volume_molar": 18.20986006459949,
"formula_full": "Be1 Te1 Br1",
"formula_reduced": "BeTeBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6683459905555555,
"spacegroup": 25
},
{
"id": "jvasp-109383",
"created_at": "2022-09-04T14:38:49.234713Z",
"updated_at": "2022-09-04T14:38:49.234735Z",
"structure_string": "Mn1 Cd4 S5\n1.0\n4.111527 0.001624 16.521347\n2.026254 3.577562 16.521347\n0.002786 0.001624 17.025263\nMn Cd S\n1 4 5\ndirect\n0.400714 0.400712 0.400714 Mn\n0.002102 0.002102 0.002102 Cd\n0.600575 0.600572 0.600574 Cd\n0.199040 0.199039 0.199039 Cd\n0.797379 0.797375 0.797378 Cd\n0.951613 0.951608 0.951611 S\n0.550060 0.550057 0.550059 S\n0.148505 0.148504 0.148505 S\n0.746632 0.746628 0.746631 S\n0.353391 0.353389 0.353391 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"Cd",
"S"
],
"chemical_system": "Cd-Mn-S",
"density": 4.413730153014161,
"density_atomic": 0.039975669482180225,
"volume": 250.15215828862242,
"volume_molar": 15.06451508631885,
"formula_full": "Mn1 Cd4 S5",
"formula_reduced": "MnCd4S5",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.6681756241379311,
"spacegroup": 160
},
{
"id": "jvasp-40115",
"created_at": "2022-09-04T14:37:40.727820Z",
"updated_at": "2022-09-04T14:37:40.727844Z",
"structure_string": "Ac2 Zn1 Si1\n1.0\n-0.000000 3.878122 3.878122\n3.878122 0.000000 3.878122\n3.878122 3.878122 0.000000\nAc Zn Si\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Ac\n0.000000 0.000000 0.000000 Ac\n0.750000 0.750000 0.750000 Zn\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Zn",
"Si"
],
"chemical_system": "Ac-Si-Zn",
"density": 7.793534474752304,
"density_atomic": 0.03428985068605463,
"volume": 116.65259311341252,
"volume_molar": 17.562458393699423,
"formula_full": "Ac2 Zn1 Si1",
"formula_reduced": "Ac2ZnSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6680672499999999,
"spacegroup": 225
},
{
"id": "jvasp-90435",
"created_at": "2022-09-04T14:38:15.070041Z",
"updated_at": "2022-09-04T14:38:15.070071Z",
"structure_string": "Ba2 Ag2 O4\n1.0\n-1.956153 3.135440 -0.014221\n-5.113598 -3.193555 -0.833645\n-0.723591 -0.423573 6.028236\nBa Ag O\n2 2 4\ndirect\n0.000001 0.500000 0.000000 Ba\n0.000000 -0.000000 0.500000 Ba\n0.500000 -0.000000 0.000000 Ag\n0.500001 0.499999 0.500001 Ag\n0.500001 0.250008 0.749992 O\n0.500001 0.749991 0.250009 O\n0.500113 0.250004 0.250004 O\n0.499889 0.749995 0.749997 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Ag",
"O"
],
"chemical_system": "Ag-Ba-O",
"density": 6.724686719375285,
"density_atomic": 0.05843850877721088,
"volume": 136.89603255447443,
"volume_molar": 10.305089719107343,
"formula_full": "Ba2 Ag2 O4",
"formula_reduced": "BaAgO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6678500575,
"spacegroup": 123
},
{
"id": "jvasp-104933",
"created_at": "2022-09-04T14:36:59.562036Z",
"updated_at": "2022-09-04T14:36:59.562062Z",
"structure_string": "Sb1 Pb1\n1.0\n3.378036 0.012717 0.000000\n-0.832734 3.273812 0.000000\n-0.000000 -0.000000 5.424470\nSb Pb\n1 1\ndirect\n0.500001 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sb",
"Pb"
],
"chemical_system": "Pb-Sb",
"density": 9.097062913939324,
"density_atomic": 0.03330726738159684,
"volume": 60.04695543126584,
"volume_molar": 18.080560890826472,
"formula_full": "Sb1 Pb1",
"formula_reduced": "SbPb",
"formula_anonymous": "AB",
"energy_above_hull": 0.66780346,
"spacegroup": 65
},
{
"id": "jvasp-12881",
"created_at": "2022-09-04T14:36:31.661618Z",
"updated_at": "2022-09-04T14:36:31.661646Z",
"structure_string": "Fe2 Se2 Cl14\n1.0\n6.275703 0.048854 -0.101402\n0.929530 8.083430 -0.000785\n2.228524 0.544213 9.372093\nFe Se Cl\n2 2 14\ndirect\n0.495762 0.124633 0.121580 Fe\n0.763747 0.553654 0.555887 Fe\n0.952372 0.514878 0.077322 Se\n0.181790 0.948331 0.548535 Se\n0.108523 0.614464 0.507527 Cl\n0.661664 0.626922 -0.003633 Cl\n0.179813 0.481462 0.871028 Cl\n0.063718 0.747408 0.125034 Cl\n0.408494 0.045697 0.935355 Cl\n0.483651 0.911848 0.282988 Cl\n0.841828 0.183523 0.069512 Cl\n0.545123 0.767538 0.653276 Cl\n0.724471 0.344219 0.708808 Cl\n0.316398 0.180471 0.570460 Cl\n0.979362 0.930194 0.764503 Cl\n0.921987 0.048591 0.433402 Cl\n0.277551 0.339758 0.215259 Cl\n0.677338 0.486200 0.358458 Cl\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Fe",
"Se",
"Cl"
],
"chemical_system": "Cl-Fe-Se",
"density": 2.667610490083663,
"density_atomic": 0.0377523742550949,
"volume": 476.79120466365885,
"volume_molar": 15.951687486747346,
"formula_full": "Fe2 Se2 Cl14",
"formula_reduced": "FeSeCl7",
"formula_anonymous": "ABC7",
"energy_above_hull": 0.6677430376851851,
"spacegroup": 1
},
{
"id": "jvasp-79434",
"created_at": "2022-09-04T14:36:45.932621Z",
"updated_at": "2022-09-04T14:36:45.932648Z",
"structure_string": "Li1 Er2 Ga1\n1.0\n-0.000007 3.535719 3.535765\n3.535764 0.000006 3.535753\n3.535780 3.535722 -0.000010\nLi Er Ga\n1 2 1\ndirect\n0.750001 0.749999 0.749997 Li\n0.999999 0.999990 0.000002 Er\n0.499997 0.500005 0.500004 Er\n0.250004 0.249999 0.249999 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Er",
"Ga"
],
"chemical_system": "Er-Ga-Li",
"density": 7.723385038520223,
"density_atomic": 0.04524644742398269,
"volume": 88.40473070775975,
"volume_molar": 13.309643304300593,
"formula_full": "Li1 Er2 Ga1",
"formula_reduced": "LiEr2Ga",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.66773808125,
"spacegroup": 225
},
{
"id": "jvasp-66619",
"created_at": "2022-09-04T14:36:06.216928Z",
"updated_at": "2022-09-04T14:36:06.216954Z",
"structure_string": "K1 Ba1 Si1\n1.0\n-0.000000 3.884156 3.884156\n3.884156 0.000000 3.884156\n3.884156 3.884156 0.000000\nK Ba Si\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.750001 0.750001 0.750001 Ba\n0.500001 0.500001 0.500001 Si\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Ba",
"Si"
],
"chemical_system": "Ba-K-Si",
"density": 2.8976461953039965,
"density_atomic": 0.025597718947111076,
"volume": 117.19794276194973,
"volume_molar": 23.526083603162817,
"formula_full": "K1 Ba1 Si1",
"formula_reduced": "KBaSi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6676975233333331,
"spacegroup": 216
},
{
"id": "jvasp-10783",
"created_at": "2022-09-04T14:38:09.124385Z",
"updated_at": "2022-09-04T14:38:09.124402Z",
"structure_string": "Y4 Mg8\n1.0\n3.018114 -5.227526 -0.000000\n3.018114 5.227526 0.000000\n0.000000 -0.000000 9.786138\nY Mg\n4 8\ndirect\n0.333332 0.666666 0.065300 Y\n0.666666 0.333332 0.565300 Y\n0.666666 0.333332 0.934700 Y\n0.333332 0.666666 0.434700 Y\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.342250 0.171125 0.250000 Mg\n0.171125 0.342250 0.750000 Mg\n0.171124 0.828874 0.750000 Mg\n0.828874 0.171124 0.250000 Mg\n0.828874 0.657749 0.250000 Mg\n0.657749 0.828874 0.750000 Mg\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.957935322519523,
"density_atomic": 0.0388604721797765,
"volume": 308.7970713398835,
"volume_molar": 15.496828582371165,
"formula_full": "Y4 Mg8",
"formula_reduced": "YMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6676784404761904,
"spacegroup": 194
},
{
"id": "jvasp-91950",
"created_at": "2022-09-04T14:35:46.370247Z",
"updated_at": "2022-09-04T14:35:46.370273Z",
"structure_string": "Mg3 Cu1 O4\n1.0\n4.231148 0.000000 0.000000\n0.000000 4.231148 0.000000\n-0.000000 -0.000000 4.231148\nMg Cu O\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Cu",
"O"
],
"chemical_system": "Cu-Mg-O",
"density": 4.394395491558648,
"density_atomic": 0.10561250338741607,
"volume": 75.74860687331473,
"volume_molar": 5.7021096620625595,
"formula_full": "Mg3 Cu1 O4",
"formula_reduced": "Mg3CuO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6675652000000001,
"spacegroup": 221
},
{
"id": "jvasp-50936",
"created_at": "2022-09-04T14:35:50.837151Z",
"updated_at": "2022-09-04T14:35:50.837180Z",
"structure_string": "K1 Nd1 O2\n1.0\n1.816172 1.048568 6.233631\n-1.816172 1.048568 6.233631\n-0.000000 -2.097135 6.233631\nK Nd O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500001 0.500001 0.499999 Nd\n0.231418 0.231418 0.231417 O\n0.768583 0.768583 0.768580 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Nd",
"O"
],
"chemical_system": "K-Nd-O",
"density": 5.0202600289161,
"density_atomic": 0.056158333635428416,
"volume": 71.2271846591355,
"volume_molar": 10.723503298895666,
"formula_full": "K1 Nd1 O2",
"formula_reduced": "KNdO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6675291250000002,
"spacegroup": 166
}
]
}