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=467",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=465",
"results": [
{
"id": "jvasp-85836",
"created_at": "2022-09-04T14:35:41.506594Z",
"updated_at": "2022-09-04T14:35:41.506625Z",
"structure_string": "La1 Mg1\n1.0\n3.952610 0.000000 0.000000\n0.000000 3.952610 0.000000\n0.000000 0.000000 3.952610\nLa Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Mg"
],
"chemical_system": "La-Mg",
"density": 4.3887942140153795,
"density_atomic": 0.032387550299448065,
"volume": 61.75212331616458,
"volume_molar": 18.593998941941052,
"formula_full": "La1 Mg1",
"formula_reduced": "LaMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.6255914285714286,
"spacegroup": 221
},
{
"id": "jvasp-18743",
"created_at": "2022-09-04T14:35:43.674858Z",
"updated_at": "2022-09-04T14:35:43.674888Z",
"structure_string": "Pr2 Mg4\n1.0\n5.317442 0.000000 3.070026\n1.772481 5.013332 3.070026\n-0.000000 0.000000 6.140052\nPr Mg\n2 4\ndirect\n0.875000 0.875000 0.875001 Pr\n0.125000 0.125000 0.125000 Pr\n0.500000 0.500000 0.500001 Mg\n0.500000 0.500000 0.000001 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Mg"
],
"chemical_system": "Mg-Pr",
"density": 3.8452756597418145,
"density_atomic": 0.03665641373028248,
"volume": 163.68213334091925,
"volume_molar": 16.428614114601746,
"formula_full": "Pr2 Mg4",
"formula_reduced": "PrMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1809988722222223,
"spacegroup": 227
},
{
"id": "jvasp-85977",
"created_at": "2022-09-04T14:35:45.438210Z",
"updated_at": "2022-09-04T14:35:45.438238Z",
"structure_string": "Ce2 P10\n1.0\n4.660161 -0.182456 0.000000\n-1.493051 5.369551 0.000000\n0.000000 0.000000 9.613464\nCe P\n2 10\ndirect\n0.415150 0.103942 0.250000 Ce\n0.584850 0.896057 0.750000 Ce\n0.230740 0.559360 0.250000 P\n0.769259 0.440639 0.750000 P\n0.133882 0.479018 0.906636 P\n0.866118 0.520981 0.406636 P\n0.866118 0.520981 0.093364 P\n0.133882 0.479018 0.593363 P\n0.212611 0.109694 0.946713 P\n0.787389 0.890305 0.446713 P\n0.787389 0.890305 0.053286 P\n0.212611 0.109694 0.553286 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 4.117312981025795,
"density_atomic": 0.05043318332211312,
"volume": 237.9385795133506,
"volume_molar": 11.94083015053208,
"formula_full": "Ce2 P10",
"formula_reduced": "CeP5",
"formula_anonymous": "AB5",
"energy_above_hull": 3.0606355,
"spacegroup": 11
},
{
"id": "jvasp-1245",
"created_at": "2022-09-04T14:35:47.121068Z",
"updated_at": "2022-09-04T14:35:47.121107Z",
"structure_string": "Cd1 F2\n1.0\n3.333099 0.000000 1.924366\n1.111033 3.142476 1.924366\n0.000000 0.000000 3.848731\nCd F\n1 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.749999 0.750001 0.750001 F\n0.250000 0.250000 0.250000 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cd",
"F"
],
"chemical_system": "Cd-F",
"density": 6.195576646643331,
"density_atomic": 0.07441894585402718,
"volume": 40.31231517152234,
"volume_molar": 8.092214544146369,
"formula_full": "Cd1 F2",
"formula_reduced": "CdF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-1375",
"created_at": "2022-09-04T14:35:46.136120Z",
"updated_at": "2022-09-04T14:35:46.136150Z",
"structure_string": "Li3 N1\n1.0\n1.801662 -3.120570 0.000000\n1.801662 3.120570 0.000000\n0.000000 0.000000 3.839690\nLi N\n3 1\ndirect\n0.000000 0.000000 0.500000 Li\n0.666666 0.333332 0.000000 Li\n0.333332 0.666666 0.000000 Li\n0.000000 0.000000 0.000000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"N"
],
"chemical_system": "Li-N",
"density": 1.3395700379089321,
"density_atomic": 0.09264598120516611,
"volume": 43.17510536309105,
"volume_molar": 6.5001640456091305,
"formula_full": "Li3 N1",
"formula_reduced": "Li3N",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6751733125,
"spacegroup": 191
},
{
"id": "jvasp-228",
"created_at": "2022-09-04T14:35:41.828899Z",
"updated_at": "2022-09-04T14:35:41.828920Z",
"structure_string": "Mo2 S4\n1.0\n0.000000 5.553056 0.007297\n3.205943 0.000000 0.000000\n0.000000 -1.843849 -6.127820\nMo S\n2 4\ndirect\n0.500000 0.499999 -0.000000 Mo\n0.000000 0.000000 0.000000 Mo\n0.752817 0.000000 0.258308 S\n0.747184 0.499999 0.741691 S\n0.252816 0.499999 0.258309 S\n0.247184 0.000000 0.741691 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mo",
"S"
],
"chemical_system": "Mo-S",
"density": 4.874913798596454,
"density_atomic": 0.05502108533421523,
"volume": 109.04910296760104,
"volume_molar": 10.945150797043787,
"formula_full": "Mo2 S4",
"formula_reduced": "MoS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.6621086333333324,
"spacegroup": 166
},
{
"id": "jvasp-23439",
"created_at": "2022-09-04T14:35:46.429725Z",
"updated_at": "2022-09-04T14:35:46.429752Z",
"structure_string": "Te4 O12\n1.0\n5.202465 0.000000 0.000000\n0.000000 4.820473 0.000000\n0.000000 0.000000 8.485175\nTe O\n4 12\ndirect\n0.000000 0.000000 0.099427 Te\n0.000000 0.500000 0.414633 Te\n0.500000 0.000000 0.914633 Te\n0.500000 0.500000 0.599428 Te\n0.142836 0.250000 0.257030 O\n0.184880 0.282281 0.580868 O\n0.184880 0.217718 0.933192 O\n0.315120 0.717718 0.433192 O\n0.315120 0.782281 0.080868 O\n0.357165 0.749999 0.757030 O\n0.642836 0.250000 0.757030 O\n0.684881 0.217719 0.080868 O\n0.684880 0.282282 0.433192 O\n0.815121 0.782281 0.933192 O\n0.815121 0.717719 0.580868 O\n0.857165 0.750000 0.257030 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Te",
"O"
],
"chemical_system": "O-Te",
"density": 5.481122684467703,
"density_atomic": 0.07519004714194216,
"volume": 212.79412113940484,
"volume_molar": 8.009225940012422,
"formula_full": "Te4 O12",
"formula_reduced": "TeO3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.820652066666667,
"spacegroup": 52
},
{
"id": "jvasp-1372",
"created_at": "2022-09-04T14:35:41.278988Z",
"updated_at": "2022-09-04T14:35:41.279014Z",
"structure_string": "Al1 As1\n1.0\n3.505894 -0.000000 2.024129\n1.168631 3.305388 2.024129\n-0.000000 -0.000000 4.048257\nAl As\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Al",
"As"
],
"chemical_system": "Al-As",
"density": 3.607010072999548,
"density_atomic": 0.04263248941745114,
"volume": 46.91257834878678,
"volume_molar": 14.125707511546118,
"formula_full": "Al1 As1",
"formula_reduced": "AlAs",
"formula_anonymous": "AB",
"energy_above_hull": 1.0452322749999998,
"spacegroup": 216
},
{
"id": "jvasp-92506",
"created_at": "2022-09-04T14:35:43.705978Z",
"updated_at": "2022-09-04T14:35:43.706010Z",
"structure_string": "K2 O4\n1.0\n3.874259 0.000000 0.000000\n0.000000 3.875646 0.000000\n0.000000 0.000000 6.684520\nK O\n2 4\ndirect\n0.500000 0.500001 0.500000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.500089 0.898586 O\n0.500000 0.499912 0.101414 O\n0.000000 -0.000089 0.398586 O\n0.000000 0.000089 0.601414 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"K",
"O"
],
"chemical_system": "K-O",
"density": 2.352491159958247,
"density_atomic": 0.059778948396573404,
"volume": 100.36978168628886,
"volume_molar": 10.074015889421695,
"formula_full": "K2 O4",
"formula_reduced": "KO2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9394600833333332,
"spacegroup": 139
},
{
"id": "jvasp-85849",
"created_at": "2022-09-04T14:35:46.429406Z",
"updated_at": "2022-09-04T14:35:46.429429Z",
"structure_string": "Nd2 Fe17\n1.0\n6.270945 0.033573 0.787573\n0.698996 6.231956 0.787573\n0.037348 0.033573 6.320097\nNd Fe\n2 17\ndirect\n0.655248 0.655247 0.655246 Nd\n0.344754 0.344753 0.344753 Nd\n0.334888 0.334887 0.848439 Fe\n0.334888 0.848439 0.334887 Fe\n0.848440 0.334887 0.334887 Fe\n0.151562 0.665113 0.665112 Fe\n0.665114 0.665113 0.151561 Fe\n0.665114 0.151561 0.665112 Fe\n0.287093 -0.000000 0.712908 Fe\n0.090973 0.090973 0.090973 Fe\n0.712908 -0.000000 0.287092 Fe\n0.000000 0.287092 0.712908 Fe\n0.287093 0.712908 -0.000001 Fe\n0.000000 0.500000 -0.000000 Fe\n0.500000 -0.000000 -0.000000 Fe\n0.000000 -0.000000 0.500000 Fe\n0.909029 0.909027 0.909026 Fe\n0.712908 0.287092 -0.000001 Fe\n0.000001 0.712908 0.287092 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Nd",
"Fe"
],
"chemical_system": "Fe-Nd",
"density": 8.338288078651336,
"density_atomic": 0.07707503467418117,
"volume": 246.51302565504622,
"volume_molar": 7.813348103516734,
"formula_full": "Nd2 Fe17",
"formula_reduced": "Nd2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.094622447368421,
"spacegroup": 166
},
{
"id": "jvasp-15085",
"created_at": "2022-09-04T14:35:42.905395Z",
"updated_at": "2022-09-04T14:35:42.905429Z",
"structure_string": "V2 Sb4\n1.0\n5.263797 -0.016732 -1.467630\n-3.038658 4.298186 -1.467630\n0.008695 0.016732 5.464561\nV Sb\n2 4\ndirect\n0.750001 0.750001 0.000000 V\n0.250000 0.250000 0.000000 V\n0.843135 0.656867 0.500000 Sb\n0.343134 0.843135 0.186269 Sb\n0.156867 0.343134 0.500000 Sb\n0.656867 0.156866 0.813731 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"V",
"Sb"
],
"chemical_system": "Sb-V",
"density": 7.9110543294247195,
"density_atomic": 0.048537567133496516,
"volume": 123.61559003354556,
"volume_molar": 12.407174721874407,
"formula_full": "V2 Sb4",
"formula_reduced": "VSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2356288000000006,
"spacegroup": 140
},
{
"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
}
]
}