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=619",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=617",
"results": [
{
"id": "jvasp-94282",
"created_at": "2022-09-04T14:35:47.482858Z",
"updated_at": "2022-09-04T14:35:47.482870Z",
"structure_string": "Zn3 Te3\n1.0\n-2.167402 -3.754050 0.000000\n-2.167402 3.754050 -0.000000\n0.000000 -0.000000 -9.802098\nZn Te\n3 3\ndirect\n0.499706 0.499706 0.666633 Zn\n0.500293 -0.000000 0.999967 Zn\n-0.000000 0.500293 0.333300 Zn\n0.499852 0.499852 0.166633 Te\n0.500148 -0.000000 0.499967 Te\n-0.000000 0.500148 0.833300 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zn",
"Te"
],
"chemical_system": "Te-Zn",
"density": 6.027807221517951,
"density_atomic": 0.03761514082210696,
"volume": 159.51023627362613,
"volume_molar": 16.009884925010578,
"formula_full": "Zn3 Te3",
"formula_reduced": "ZnTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.06408,
"spacegroup": 181
},
{
"id": "jvasp-18912",
"created_at": "2022-09-04T14:35:41.981847Z",
"updated_at": "2022-09-04T14:35:41.981870Z",
"structure_string": "Y1 Mg1\n1.0\n3.778347 -0.000000 0.000000\n-0.000000 3.778347 -0.000000\n-0.000000 -0.000000 3.778347\nY Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 3.4852314687985215,
"density_atomic": 0.0370786978342437,
"volume": 53.93932680540139,
"volume_molar": 16.241510926088417,
"formula_full": "Y1 Mg1",
"formula_reduced": "YMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.8870051928571426,
"spacegroup": 221
},
{
"id": "jvasp-14579",
"created_at": "2022-09-04T14:35:45.688032Z",
"updated_at": "2022-09-04T14:35:45.688065Z",
"structure_string": "Ba2 Si2\n1.0\n4.150396 0.000000 -0.000000\n0.000000 4.659789 -1.964072\n-0.000000 0.019184 6.555256\nBa Si\n2 2\ndirect\n0.250000 0.858524 0.717049 Ba\n0.750001 0.141476 0.282952 Ba\n0.250000 0.559014 0.118029 Si\n0.750001 0.440985 0.881972 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Si"
],
"chemical_system": "Ba-Si",
"density": 4.327794197293089,
"density_atomic": 0.03151223256454847,
"volume": 126.93483369693185,
"volume_molar": 19.11048589675287,
"formula_full": "Ba2 Si2",
"formula_reduced": "BaSi",
"formula_anonymous": "AB",
"energy_above_hull": 0.7193672849999999,
"spacegroup": 63
},
{
"id": "jvasp-63490",
"created_at": "2022-09-04T14:35:44.783673Z",
"updated_at": "2022-09-04T14:35:44.783718Z",
"structure_string": "As16 Se16\n1.0\n0.000000 6.770979 -0.023812\n13.909657 0.000000 0.000000\n0.000000 -4.099925 -9.206324\nAs Se\n16 16\ndirect\n0.353663 0.978269 0.112442 As\n0.661654 0.839979 0.964820 As\n0.661654 0.660022 0.464820 As\n0.338346 0.160022 0.035180 As\n0.149302 0.367307 0.826475 As\n0.850698 0.867307 0.673524 As\n0.850698 0.632693 0.173524 As\n0.149302 0.132693 0.326475 As\n0.338346 0.339979 0.535179 As\n0.429323 0.862013 0.568466 As\n0.429322 0.637987 0.068466 As\n0.570678 0.137987 0.431533 As\n0.353663 0.521732 0.612442 As\n0.646338 0.021732 0.887557 As\n0.646337 0.478269 0.387557 As\n0.570678 0.362013 0.931533 As\n0.945287 0.720903 0.399095 Se\n0.054713 0.220903 0.100905 Se\n0.624894 0.269524 0.744299 Se\n0.375107 0.769524 0.755700 Se\n0.375107 0.730476 0.255701 Se\n0.624894 0.230476 0.244299 Se\n0.081300 0.525141 0.712054 Se\n0.081300 0.974860 0.212054 Se\n0.918700 0.474859 0.287946 Se\n0.656146 0.514731 0.849665 Se\n0.343855 0.014731 0.650334 Se\n0.343855 0.485269 0.150334 Se\n0.656146 0.985269 0.349665 Se\n0.945287 0.779098 0.899095 Se\n0.918701 0.025141 0.787946 Se\n0.054713 0.279098 0.600905 Se\n",
"nsites": 32,
"nelements": 2,
"elements": [
"As",
"Se"
],
"chemical_system": "As-Se",
"density": 4.707843217589177,
"density_atomic": 0.036848193081084335,
"volume": 868.4279288697848,
"volume_molar": 16.343110086153473,
"formula_full": "As16 Se16",
"formula_reduced": "AsSe",
"formula_anonymous": "AB",
"energy_above_hull": 1.1981425583333332,
"spacegroup": 14
},
{
"id": "jvasp-14896",
"created_at": "2022-09-04T14:37:00.206810Z",
"updated_at": "2022-09-04T14:37:00.206832Z",
"structure_string": "Ge1 As1\n1.0\n3.306431 -0.000000 -1.776410\n-0.954393 3.165694 -1.776410\n0.029610 0.039854 4.020447\nGe As\n1 1\ndirect\n0.997294 0.997291 0.994588 Ge\n0.416706 0.416705 0.833411 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"As"
],
"chemical_system": "As-Ge",
"density": 5.758573055822138,
"density_atomic": 0.04700265859259937,
"volume": 42.550784570192434,
"volume_molar": 12.812340706506747,
"formula_full": "Ge1 As1",
"formula_reduced": "GeAs",
"formula_anonymous": "AB",
"energy_above_hull": 1.0675088499999998,
"spacegroup": 107
},
{
"id": "jvasp-15056",
"created_at": "2022-09-04T14:35:46.746492Z",
"updated_at": "2022-09-04T14:35:46.746518Z",
"structure_string": "Ho1 Ag1\n1.0\n3.589878 0.000000 -0.000000\n-0.000000 3.589878 0.000000\n0.000000 0.000000 3.589878\nHo Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ho",
"Ag"
],
"chemical_system": "Ag-Ho",
"density": 9.791563361199655,
"density_atomic": 0.04323056653091849,
"volume": 46.26356211569887,
"volume_molar": 13.930284155987101,
"formula_full": "Ho1 Ag1",
"formula_reduced": "HoAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.1893514133333332,
"spacegroup": 221
},
{
"id": "jvasp-14704",
"created_at": "2022-09-04T14:35:42.754818Z",
"updated_at": "2022-09-04T14:35:42.754849Z",
"structure_string": "Mn1 Rh1\n1.0\n2.944952 -0.000000 0.000000\n0.000000 2.944952 0.000000\n0.000000 -0.000000 2.944952\nMn Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Rh"
],
"chemical_system": "Mn-Rh",
"density": 10.26221860843258,
"density_atomic": 0.07830605298585921,
"volume": 25.540809729755722,
"volume_molar": 7.690517565848326,
"formula_full": "Mn1 Rh1",
"formula_reduced": "MnRh",
"formula_anonymous": "AB",
"energy_above_hull": 2.568325120689655,
"spacegroup": 221
},
{
"id": "jvasp-105696",
"created_at": "2022-09-04T14:35:46.737611Z",
"updated_at": "2022-09-04T14:35:46.737633Z",
"structure_string": "Fe4 O4\n1.0\n3.037194 0.019133 -0.014847\n1.491182 4.960454 0.900821\n0.025560 -0.033799 5.257550\nFe O\n4 4\ndirect\n0.493150 0.000038 0.499974 Fe\n0.751015 0.499985 0.249996 Fe\n0.006844 0.999994 0.000025 Fe\n0.248977 0.499979 0.750001 Fe\n0.870963 0.249982 0.625056 O\n0.379061 0.250018 0.125031 O\n0.122000 0.749981 0.374974 O\n0.627987 0.750018 0.874944 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 6.02869518762918,
"density_atomic": 0.1010674486294937,
"volume": 79.1550603926636,
"volume_molar": 5.958536444386514,
"formula_full": "Fe4 O4",
"formula_reduced": "FeO",
"formula_anonymous": "AB",
"energy_above_hull": 1.4425044999999996,
"spacegroup": 225
},
{
"id": "jvasp-19857",
"created_at": "2022-09-04T14:35:46.627237Z",
"updated_at": "2022-09-04T14:35:46.627261Z",
"structure_string": "Th1 N1\n1.0\n3.174468 -0.000000 1.832780\n1.058156 2.992917 1.832780\n-0.000000 -0.000000 3.665560\nTh N\n1 1\ndirect\n0.500001 0.500001 0.499999 Th\n0.000000 0.000000 0.000000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Th",
"N"
],
"chemical_system": "N-Th",
"density": 11.731600312801811,
"density_atomic": 0.057428045570381135,
"volume": 34.826189540942906,
"volume_molar": 10.486410777499898,
"formula_full": "Th1 N1",
"formula_reduced": "ThN",
"formula_anonymous": "AB",
"energy_above_hull": 1.956859425,
"spacegroup": 225
},
{
"id": "jvasp-78458",
"created_at": "2022-09-04T14:36:32.300645Z",
"updated_at": "2022-09-04T14:36:32.300670Z",
"structure_string": "Ag1 Br1\n1.0\n-0.000000 0.000000 3.565431\n3.566097 0.000000 -0.000000\n0.000000 3.566097 0.000000\nAg Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"Br"
],
"chemical_system": "Ag-Br",
"density": 6.876731246722897,
"density_atomic": 0.0441094512933937,
"volume": 45.34175650241066,
"volume_molar": 13.652721998158112,
"formula_full": "Ag1 Br1",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.087405,
"spacegroup": 221
},
{
"id": "jvasp-91719",
"created_at": "2022-09-04T14:35:45.641121Z",
"updated_at": "2022-09-04T14:35:45.641149Z",
"structure_string": "Mg4 Al4\n1.0\n5.793312 0.000000 -0.000000\n-0.000000 5.793312 -0.000000\n0.000000 0.000000 5.793312\nMg Al\n4 4\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Al"
],
"chemical_system": "Al-Mg",
"density": 1.751990404587586,
"density_atomic": 0.04114425780429604,
"volume": 194.43782503143578,
"volume_molar": 14.636649392594471,
"formula_full": "Mg4 Al4",
"formula_reduced": "MgAl",
"formula_anonymous": "AB",
"energy_above_hull": 0.8067104857142858,
"spacegroup": 225
},
{
"id": "jvasp-37168",
"created_at": "2022-09-04T14:35:43.798004Z",
"updated_at": "2022-09-04T14:35:43.798029Z",
"structure_string": "Y1 Ti1\n1.0\n3.635023 -0.000000 0.000000\n-0.000000 3.635023 0.000000\n0.000000 -0.000000 3.635023\nY Ti\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Ti\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Ti"
],
"chemical_system": "Ti-Y",
"density": 4.7285447633095705,
"density_atomic": 0.04163978766904659,
"volume": 48.03098459329375,
"volume_molar": 14.462467503110314,
"formula_full": "Y1 Ti1",
"formula_reduced": "YTi",
"formula_anonymous": "AB",
"energy_above_hull": 2.418996891666666,
"spacegroup": 221
}
]
}