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=density&page=3487",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3485",
"results": [
{
"id": "jvasp-41983",
"created_at": "2022-09-04T14:37:33.896089Z",
"updated_at": "2022-09-04T14:37:33.896108Z",
"structure_string": "Be1 Co2 Ge1\n1.0\n-0.000000 2.748702 2.748702\n2.748702 -0.000000 2.748702\n2.748702 2.748702 0.000000\nBe Co Ge\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.749999 0.749999 0.749999 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Co",
"Ge"
],
"chemical_system": "Be-Co-Ge",
"density": 7.976630123489601,
"density_atomic": 0.0963045974701762,
"volume": 41.53488104489226,
"volume_molar": 6.253222502554927,
"formula_full": "Be1 Co2 Ge1",
"formula_reduced": "BeCo2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2299359625,
"spacegroup": 225
},
{
"id": "jvasp-65237",
"created_at": "2022-09-04T14:36:07.662316Z",
"updated_at": "2022-09-04T14:36:07.662335Z",
"structure_string": "Be1 In1 Bi4\n1.0\n0.000000 4.640005 4.640005\n4.640005 0.000000 4.640005\n4.640005 4.640005 -0.000000\nBe In Bi\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 In\n0.124093 0.625303 0.625303 Bi\n0.625303 0.625303 0.625303 Bi\n0.625303 0.124093 0.625303 Bi\n0.625303 0.625303 0.124093 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"In",
"Bi"
],
"chemical_system": "Be-Bi-In",
"density": 7.976689431284734,
"density_atomic": 0.03003073136504048,
"volume": 199.79533388869606,
"volume_molar": 20.05326039781543,
"formula_full": "Be1 In1 Bi4",
"formula_reduced": "BeInBi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0136588783333331,
"spacegroup": 216
},
{
"id": "jvasp-109376",
"created_at": "2022-09-04T14:38:11.766723Z",
"updated_at": "2022-09-04T14:38:11.766751Z",
"structure_string": "Nb5 N2 O2\n1.0\n4.241878 0.001923 3.389393\n1.982028 3.750346 3.389393\n-0.018947 -0.011423 6.844825\nNb N O\n5 2 2\ndirect\n0.581876 0.581877 0.621856 Nb\n0.771477 0.771477 0.821842 Nb\n0.999381 0.999382 0.979007 Nb\n0.222356 0.222356 0.139148 Nb\n0.399783 0.399784 0.451482 Nb\n0.485545 0.485545 0.040206 N\n0.696814 0.696814 0.210179 N\n0.907713 0.907713 0.384747 O\n0.135056 0.135057 0.551530 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Nb",
"N",
"O"
],
"chemical_system": "N-Nb-O",
"density": 7.976932799272825,
"density_atomic": 0.0824227952429443,
"volume": 109.19309365172779,
"volume_molar": 7.306401999895191,
"formula_full": "Nb5 N2 O2",
"formula_reduced": "Nb5(NO)2",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 5.4534445,
"spacegroup": 8
},
{
"id": "jvasp-18752",
"created_at": "2022-09-04T14:36:39.473540Z",
"updated_at": "2022-09-04T14:36:39.473563Z",
"structure_string": "Nb5 Te4\n1.0\n3.636624 0.000000 0.934842\n1.818311 7.351691 0.467422\n-0.012029 -0.000001 7.587619\nNb Te\n5 4\ndirect\n0.000000 0.000000 0.000000 Nb\n0.315813 0.065972 0.302399 Nb\n0.618213 0.697601 0.065972 Nb\n0.381785 0.302399 0.934028 Nb\n0.684185 0.934028 0.697601 Nb\n0.061104 0.225585 0.652205 Te\n0.713310 0.347795 0.225585 Te\n0.286689 0.652205 0.774415 Te\n0.938894 0.774415 0.347795 Te\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Nb",
"Te"
],
"chemical_system": "Nb-Te",
"density": 7.977287859930569,
"density_atomic": 0.044348036363287005,
"volume": 202.94021422446886,
"volume_molar": 13.579272621381175,
"formula_full": "Nb5 Te4",
"formula_reduced": "Nb5Te4",
"formula_anonymous": "A4B5",
"energy_above_hull": 4.054559785185185,
"spacegroup": 87
},
{
"id": "jvasp-99853",
"created_at": "2022-09-04T14:36:21.073984Z",
"updated_at": "2022-09-04T14:36:21.074011Z",
"structure_string": "Y2 Zn1 Au1\n1.0\n4.382404 -0.000000 2.530182\n1.460802 4.131769 2.530182\n-0.000000 0.000000 5.060364\nY Zn Au\n2 1 1\ndirect\n0.749999 0.750000 0.749999 Y\n0.250000 0.250000 0.250000 Y\n0.000000 0.000000 0.000000 Zn\n0.499999 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Zn",
"Au"
],
"chemical_system": "Au-Y-Zn",
"density": 7.977308245730427,
"density_atomic": 0.043654577532362994,
"volume": 91.6284208004219,
"volume_molar": 13.794981191916314,
"formula_full": "Y2 Zn1 Au1",
"formula_reduced": "Y2ZnAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0391442399999995,
"spacegroup": 225
},
{
"id": "jvasp-100509",
"created_at": "2022-09-04T14:36:59.756947Z",
"updated_at": "2022-09-04T14:36:59.756972Z",
"structure_string": "Ti2 Mo1 Pd1\n1.0\n3.848362 0.000000 2.221853\n1.282787 3.628271 2.221853\n0.000000 0.000000 4.443706\nTi Mo Pd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ti\n0.750000 0.750000 0.750000 Ti\n0.500000 0.500000 0.500000 Mo\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mo",
"Pd"
],
"chemical_system": "Mo-Pd-Ti",
"density": 7.9777675693834045,
"density_atomic": 0.06446723418786375,
"volume": 62.0470235832301,
"volume_molar": 9.34139774393128,
"formula_full": "Ti2 Mo1 Pd1",
"formula_reduced": "Ti2MoPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7206970666666663,
"spacegroup": 225
},
{
"id": "jvasp-114148",
"created_at": "2022-09-04T14:38:39.846954Z",
"updated_at": "2022-09-04T14:38:39.846978Z",
"structure_string": "Pb1 C1 O1\n1.0\n4.190419 -0.000000 0.000000\n-2.095209 3.629009 -0.000000\n-0.000000 0.000000 3.219243\nPb C O\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Pb\n0.000000 0.000000 0.000000 C\n0.333334 0.666667 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Pb",
"C",
"O"
],
"chemical_system": "C-O-Pb",
"density": 7.97821633781022,
"density_atomic": 0.06128045753557587,
"volume": 48.955248061886195,
"volume_molar": 9.827179825646528,
"formula_full": "Pb1 C1 O1",
"formula_reduced": "PbCO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.1220481066666665,
"spacegroup": 187
},
{
"id": "jvasp-37574",
"created_at": "2022-09-04T14:38:01.496994Z",
"updated_at": "2022-09-04T14:38:01.497025Z",
"structure_string": "Tm6 Mg2\n1.0\n3.426303 -5.934531 -0.000000\n3.426303 5.934531 0.000000\n0.000000 -0.000000 5.436264\nTm Mg\n6 2\ndirect\n0.168719 0.337438 0.250000 Tm\n0.168719 0.831280 0.250000 Tm\n0.662561 0.831280 0.250000 Tm\n0.337438 0.168719 0.749999 Tm\n0.831280 0.168719 0.749999 Tm\n0.831280 0.662561 0.749999 Tm\n0.666667 0.333333 0.250000 Mg\n0.333333 0.666667 0.749999 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tm",
"Mg"
],
"chemical_system": "Mg-Tm",
"density": 7.978457384455711,
"density_atomic": 0.03618655859525715,
"volume": 221.0765629713275,
"volume_molar": 16.641927261879225,
"formula_full": "Tm6 Mg2",
"formula_reduced": "Tm3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9848003619791664,
"spacegroup": 194
},
{
"id": "jvasp-112632",
"created_at": "2022-09-04T14:38:42.779184Z",
"updated_at": "2022-09-04T14:38:42.779216Z",
"structure_string": "Ta4 Cu2 O12\n1.0\n6.194751 -0.003953 -2.151230\n-3.040470 5.345894 -2.275898\n-0.010225 0.003953 6.557639\nTa Cu O\n4 2 12\ndirect\n-0.000000 0.500000 -0.000000 Ta\n0.499999 0.500000 0.500000 Ta\n-0.000001 -0.000000 0.500000 Ta\n0.500000 0.000000 0.000000 Ta\n0.500000 -0.000000 0.500000 Cu\n-0.000001 0.499999 0.499999 Cu\n0.316147 0.187147 0.503295 O\n0.683851 0.812852 0.496704 O\n0.488427 0.293968 0.194459 O\n0.511572 0.706031 0.805540 O\n0.099507 0.293968 0.805541 O\n0.822954 0.130230 0.307275 O\n0.177044 0.869769 0.692724 O\n0.683851 0.187147 0.871000 O\n0.822954 0.515679 0.692724 O\n0.177045 0.484320 0.307275 O\n0.900491 0.706032 0.194458 O\n0.316147 0.812852 0.128999 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ta",
"Cu",
"O"
],
"chemical_system": "Cu-O-Ta",
"density": 7.978478216103978,
"density_atomic": 0.08292980896549353,
"volume": 217.05102452954722,
"volume_molar": 7.261732343439701,
"formula_full": "Ta4 Cu2 O12",
"formula_reduced": "Ta2CuO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.3339788722222226,
"spacegroup": 71
},
{
"id": "jvasp-50967",
"created_at": "2022-09-04T14:36:46.182144Z",
"updated_at": "2022-09-04T14:36:46.182173Z",
"structure_string": "Tb4 Se2 O4\n1.0\n3.836647 0.000000 0.000000\n0.000000 3.836599 -0.000000\n0.000000 0.000000 12.125317\nTb Se O\n4 2 4\ndirect\n0.000000 0.000476 0.344948 Tb\n0.500000 0.499524 0.844948 Tb\n0.500000 0.500476 0.155052 Tb\n0.000000 -0.000476 0.655052 Tb\n0.000000 0.000000 0.000000 Se\n0.500000 0.500000 0.500000 Se\n0.500000 0.000435 0.249995 O\n0.000000 0.499565 0.749996 O\n0.000000 0.500435 0.250005 O\n0.500000 -0.000435 0.750005 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tb",
"Se",
"O"
],
"chemical_system": "O-Se-Tb",
"density": 7.979067480317117,
"density_atomic": 0.05602845496265082,
"volume": 178.48073816538596,
"volume_molar": 10.748361281806583,
"formula_full": "Tb4 Se2 O4",
"formula_reduced": "Tb2SeO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.2772434333333331,
"spacegroup": 139
},
{
"id": "jvasp-39844",
"created_at": "2022-09-04T14:37:45.637658Z",
"updated_at": "2022-09-04T14:37:45.637671Z",
"structure_string": "Yb1 Pm1 Zn2\n1.0\n0.000000 3.601287 3.601287\n3.601287 0.000000 3.601287\n3.601287 3.601287 0.000000\nYb Pm Zn\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Yb\n0.250000 0.250000 0.250000 Pm\n0.000000 0.000000 0.000000 Zn\n0.500001 0.500001 0.500001 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Pm",
"Zn"
],
"chemical_system": "Pm-Yb-Zn",
"density": 7.9791177097045365,
"density_atomic": 0.04282099907325263,
"volume": 93.41211290183391,
"volume_molar": 14.063522314596398,
"formula_full": "Yb1 Pm1 Zn2",
"formula_reduced": "YbPmZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-64922",
"created_at": "2022-09-04T14:36:09.215619Z",
"updated_at": "2022-09-04T14:36:09.215645Z",
"structure_string": "Be1 Cu1 Bi4\n1.0\n-0.000000 4.555376 4.555376\n4.555376 0.000000 4.555376\n4.555376 4.555376 0.000000\nBe Cu Bi\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Cu\n0.624949 0.125155 0.624949 Bi\n0.125155 0.624949 0.624949 Bi\n0.624949 0.624949 0.624949 Bi\n0.624949 0.624949 0.125155 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Bi"
],
"chemical_system": "Be-Bi-Cu",
"density": 7.979242797750916,
"density_atomic": 0.03173573540432054,
"volume": 189.0613191583124,
"volume_molar": 18.975897937377365,
"formula_full": "Be1 Cu1 Bi4",
"formula_reduced": "BeCuBi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0852722916666666,
"spacegroup": 216
}
]
}