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=406",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=404",
"results": [
{
"id": "jvasp-90807",
"created_at": "2022-09-04T14:36:07.027206Z",
"updated_at": "2022-09-04T14:36:07.027233Z",
"structure_string": "Na1 As1 F6\n1.0\n-2.546121 -4.410010 0.000000\n2.546120 -4.410010 0.000000\n-0.000000 -2.940007 4.765009\nNa As F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 As\n0.359799 0.792317 0.784508 F\n0.792317 0.063378 0.784508 F\n0.063377 0.359799 0.784508 F\n0.640202 0.207683 0.215492 F\n0.207683 0.936623 0.215492 F\n0.936623 0.640202 0.215492 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"As",
"F"
],
"chemical_system": "As-F-Na",
"density": 3.2883002909520496,
"density_atomic": 0.07476145383067247,
"volume": 107.00701484643723,
"volume_molar": 8.055141321408184,
"formula_full": "Na1 As1 F6",
"formula_reduced": "NaAsF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-90806",
"created_at": "2022-09-04T14:36:00.917168Z",
"updated_at": "2022-09-04T14:36:00.917197Z",
"structure_string": "Pr2 Co2 Ge4\n1.0\n-0.000000 -0.000000 -4.263723\n-4.288861 -0.000000 -0.000000\n2.144430 8.335405 0.000000\nPr Co Ge\n2 2 4\ndirect\n0.749999 0.107962 0.215925 Pr\n0.250000 0.892037 0.784074 Pr\n0.749999 0.316100 0.632201 Co\n0.250000 0.683899 0.367799 Co\n0.749999 0.453907 0.907813 Ge\n0.250000 0.546093 0.092187 Ge\n0.749999 0.749861 0.499723 Ge\n0.250000 0.250139 0.500276 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pr",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Pr",
"density": 7.519563387366401,
"density_atomic": 0.05248465265911365,
"volume": 152.4255109766997,
"volume_molar": 11.474098531457633,
"formula_full": "Pr2 Co2 Ge4",
"formula_reduced": "PrCoGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4758256625,
"spacegroup": 63
},
{
"id": "jvasp-90804",
"created_at": "2022-09-04T14:35:55.906989Z",
"updated_at": "2022-09-04T14:35:55.907014Z",
"structure_string": "Na4 Tl4\n1.0\n4.696805 4.040708 0.000000\n-4.696805 4.040708 0.000000\n0.000000 0.000000 6.258667\nNa Tl\n4 4\ndirect\n0.132638 0.510192 0.250000 Na\n0.489809 0.867363 0.750000 Na\n0.867363 0.489809 0.750000 Na\n0.510192 0.132638 0.250000 Na\n0.000000 0.000000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n0.642582 0.642582 0.250000 Tl\n0.357418 0.357418 0.750000 Tl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Tl"
],
"chemical_system": "Na-Tl",
"density": 6.3573522449188316,
"density_atomic": 0.03367581764565749,
"volume": 237.5591911138527,
"volume_molar": 17.882686096492026,
"formula_full": "Na4 Tl4",
"formula_reduced": "NaTl",
"formula_anonymous": "AB",
"energy_above_hull": 0.19983625,
"spacegroup": 63
},
{
"id": "jvasp-90803",
"created_at": "2022-09-04T14:35:50.864705Z",
"updated_at": "2022-09-04T14:35:50.864714Z",
"structure_string": "Mg2 Si2 Sb4\n1.0\n-6.419866 0.000000 -0.000000\n-0.000000 6.419866 -0.000000\n3.209932 -3.209932 -5.989572\nMg Si Sb\n2 2 4\ndirect\n0.750001 0.250000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.250000 0.750001 0.500000 Si\n0.500000 0.500000 -0.000000 Si\n0.875001 0.848335 0.250000 Sb\n0.375000 0.401666 0.250000 Sb\n0.598335 0.125000 0.750000 Sb\n0.151666 0.625001 0.750000 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Si",
"Sb"
],
"chemical_system": "Mg-Sb-Si",
"density": 3.9809961036926156,
"density_atomic": 0.03240725680194982,
"volume": 246.8582900703484,
"volume_molar": 18.582692132206855,
"formula_full": "Mg2 Si2 Sb4",
"formula_reduced": "MgSiSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3573049625,
"spacegroup": 122
},
{
"id": "jvasp-90802",
"created_at": "2022-09-04T14:35:44.233855Z",
"updated_at": "2022-09-04T14:35:44.233887Z",
"structure_string": "Bi8\n1.0\n5.763956 3.397402 0.000000\n-5.763956 3.397402 0.000000\n0.000000 0.000000 6.683900\nBi\n8\ndirect\n0.296385 0.703615 0.500000 Bi\n0.796385 0.203615 -0.000000 Bi\n0.703615 0.296385 0.500000 Bi\n0.203615 0.796385 -0.000000 Bi\n0.315851 0.315851 0.840838 Bi\n0.684149 0.684149 0.159162 Bi\n0.184149 0.184149 0.340838 Bi\n0.815851 0.815851 0.659162 Bi\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 10.605157097325435,
"density_atomic": 0.03056064054048965,
"volume": 261.77461789129836,
"volume_molar": 19.705544954207664,
"formula_full": "Bi8",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"energy_above_hull": 0.0822743000000001,
"spacegroup": 64
},
{
"id": "jvasp-90801",
"created_at": "2022-09-04T14:36:18.173575Z",
"updated_at": "2022-09-04T14:36:18.173601Z",
"structure_string": "La2 Co2 C4\n1.0\n2.737074 -0.002418 2.737153\n2.737074 -0.002418 -2.737153\n-1.592460 7.293280 0.000000\nLa Co C\n2 2 4\ndirect\n0.923132 0.073646 0.502130 La\n0.073646 0.923132 0.002130 La\n0.484230 0.630822 0.694602 Co\n0.630822 0.484230 0.194602 Co\n0.508090 0.152333 0.774769 C\n0.152333 0.508090 0.274769 C\n0.557725 0.404015 0.925499 C\n0.404015 0.557725 0.425499 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"La",
"Co",
"C"
],
"chemical_system": "C-Co-La",
"density": 6.743781850860214,
"density_atomic": 0.07322093514152388,
"volume": 109.25836967989186,
"volume_molar": 8.224616017755311,
"formula_full": "La2 Co2 C4",
"formula_reduced": "LaCoC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.207913975,
"spacegroup": 9
},
{
"id": "jvasp-90800",
"created_at": "2022-09-04T14:36:13.026262Z",
"updated_at": "2022-09-04T14:36:13.026286Z",
"structure_string": "Dy2 Ni2 Ge4\n1.0\n0.000000 0.000000 -4.207851\n-4.081733 0.000000 0.000000\n2.040867 8.346765 -0.000000\nDy Ni Ge\n2 2 4\ndirect\n0.750000 0.108190 0.216380 Dy\n0.250000 0.891808 0.783619 Dy\n0.750000 0.321957 0.643916 Ni\n0.250000 0.678041 0.356083 Ni\n0.750000 0.459247 0.918497 Ge\n0.250000 0.540751 0.081503 Ge\n0.750000 0.747889 0.495781 Ge\n0.250000 0.252109 0.504219 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Dy",
"Ni",
"Ge"
],
"chemical_system": "Dy-Ge-Ni",
"density": 8.489818750703717,
"density_atomic": 0.05580419595124066,
"volume": 143.35839561222352,
"volume_molar": 10.791555468807205,
"formula_full": "Dy2 Ni2 Ge4",
"formula_reduced": "DyNiGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8369226999999999,
"spacegroup": 63
},
{
"id": "jvasp-9080",
"created_at": "2022-09-04T14:38:34.249119Z",
"updated_at": "2022-09-04T14:38:34.249154Z",
"structure_string": "Hf2 Te10\n1.0\n4.012571 0.000000 0.000000\n-2.006286 7.367970 -0.000000\n0.000000 -0.000000 13.861501\nHf Te\n2 10\ndirect\n0.685665 0.371331 0.250000 Hf\n0.314334 0.628669 0.750000 Hf\n0.209088 0.418179 0.934242 Te\n0.790910 0.581821 0.065758 Te\n0.663965 0.327931 0.750000 Te\n0.336033 0.672069 0.250000 Te\n0.927674 0.855350 0.850890 Te\n0.072325 0.144650 0.149110 Te\n0.072325 0.144650 0.350890 Te\n0.927674 0.855350 0.649110 Te\n0.209088 0.418179 0.565758 Te\n0.790910 0.581821 0.434242 Te\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Hf",
"Te"
],
"chemical_system": "Hf-Te",
"density": 6.616817000082254,
"density_atomic": 0.029281977761951777,
"volume": 409.8083844456873,
"volume_molar": 20.56603146466769,
"formula_full": "Hf2 Te10",
"formula_reduced": "HfTe5",
"formula_anonymous": "AB5",
"energy_above_hull": 1.7865253055555552,
"spacegroup": 63
},
{
"id": "jvasp-90799",
"created_at": "2022-09-04T14:36:08.964789Z",
"updated_at": "2022-09-04T14:36:08.964814Z",
"structure_string": "Cu6 N2\n1.0\n3.714725 0.000000 -0.000000\n0.000000 3.714725 0.000000\n0.000000 0.000000 7.413749\nCu N\n6 2\ndirect\n0.000000 0.000000 0.762267 Cu\n0.000000 0.000000 0.237733 Cu\n0.000000 0.500001 0.500000 Cu\n0.500001 0.000000 0.500000 Cu\n0.500001 0.500001 0.831976 Cu\n0.500001 0.500001 0.168024 Cu\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"N"
],
"chemical_system": "Cu-N",
"density": 6.643369052016415,
"density_atomic": 0.0781985628080205,
"volume": 102.30367046054552,
"volume_molar": 7.701088797225739,
"formula_full": "Cu6 N2",
"formula_reduced": "Cu3N",
"formula_anonymous": "AB3",
"energy_above_hull": 1.11111865,
"spacegroup": 123
},
{
"id": "jvasp-90798",
"created_at": "2022-09-04T14:36:05.026653Z",
"updated_at": "2022-09-04T14:36:05.026679Z",
"structure_string": "Pb4 S4\n1.0\n0.000000 4.233305 -0.000000\n0.000000 -0.000000 4.233195\n11.975915 0.000000 0.000000\nPb S\n4 4\ndirect\n0.250000 0.250047 0.624985 Pb\n0.250000 0.249953 0.124985 Pb\n0.750001 0.749952 0.375015 Pb\n0.750001 0.750046 0.875015 Pb\n0.250000 0.250047 0.875021 S\n0.250000 0.249953 0.375022 S\n0.750001 0.749952 0.124979 S\n0.750001 0.750046 0.624980 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.405113576827716,
"density_atomic": 0.03727635577193032,
"volume": 214.61325374580005,
"volume_molar": 16.155390287735063,
"formula_full": "Pb4 S4",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.3970554099999999,
"spacegroup": 225
},
{
"id": "jvasp-90797",
"created_at": "2022-09-04T14:35:59.313258Z",
"updated_at": "2022-09-04T14:35:59.313277Z",
"structure_string": "Mn4 Ge4\n1.0\n4.763334 0.000000 0.000000\n-0.000000 4.763334 0.000000\n-0.000000 -0.000000 4.763334\nMn Ge\n4 4\ndirect\n0.635867 0.135868 0.364132 Mn\n0.135868 0.364132 0.635867 Mn\n0.364132 0.635867 0.135868 Mn\n0.864131 0.864131 0.864131 Mn\n0.342254 0.842254 0.657745 Ge\n0.842254 0.657745 0.342254 Ge\n0.657745 0.342254 0.842254 Ge\n0.157745 0.157745 0.157745 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn",
"density": 7.840647458702944,
"density_atomic": 0.07402132970788629,
"volume": 108.07695608239897,
"volume_molar": 8.13568303050681,
"formula_full": "Mn4 Ge4",
"formula_reduced": "MnGe",
"formula_anonymous": "AB",
"energy_above_hull": 1.659436595689655,
"spacegroup": 198
},
{
"id": "jvasp-90796",
"created_at": "2022-09-04T14:35:52.660801Z",
"updated_at": "2022-09-04T14:35:52.660816Z",
"structure_string": "Ce1 Al4 Si2 Ir1\n1.0\n4.264424 -0.000000 -0.000000\n0.000000 4.264424 -0.000000\n0.000000 0.000000 7.982966\nCe Al Si Ir\n1 4 2 1\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.500000 0.830497 Al\n0.500000 0.000000 0.830497 Al\n0.000000 0.500000 0.169504 Al\n0.500000 0.000000 0.169504 Al\n0.500000 0.500000 0.642998 Si\n0.500000 0.500000 0.357002 Si\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ce",
"Al",
"Si",
"Ir"
],
"chemical_system": "Al-Ce-Ir-Si",
"density": 5.678350732002748,
"density_atomic": 0.05510676916218679,
"volume": 145.17272780871804,
"volume_molar": 10.928132517215829,
"formula_full": "Ce1 Al4 Si2 Ir1",
"formula_reduced": "CeAl4Si2Ir",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.804545625,
"spacegroup": 123
}
]
}