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=3842",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3840",
"results": [
{
"id": "jvasp-40272",
"created_at": "2022-09-04T14:37:44.047364Z",
"updated_at": "2022-09-04T14:37:44.047374Z",
"structure_string": "Li1 Tm2 Rh1\n1.0\n-0.000000 3.416718 3.416718\n3.416718 0.000000 3.416718\n3.416718 3.416718 -0.000000\nLi Tm Rh\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Li\n0.000000 0.000000 0.000000 Tm\n0.500001 0.500001 0.500001 Tm\n0.750000 0.750000 0.750000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tm",
"Rh"
],
"chemical_system": "Li-Rh-Tm",
"density": 9.319513940273376,
"density_atomic": 0.05014210809191131,
"volume": 79.77327145216819,
"volume_molar": 12.01014673926616,
"formula_full": "Li1 Tm2 Rh1",
"formula_reduced": "LiTm2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4282903750000004,
"spacegroup": 225
},
{
"id": "jvasp-22116",
"created_at": "2022-09-04T14:37:44.063348Z",
"updated_at": "2022-09-04T14:37:44.063374Z",
"structure_string": "Pr2 Pd4 O8\n1.0\n5.314017 0.000000 -2.645885\n-1.317404 5.148128 -2.645885\n-0.013159 -0.016951 6.632871\nPr Pd O\n2 4 8\ndirect\n0.875001 0.625000 0.749999 Pr\n0.125000 0.375000 0.250000 Pr\n0.500000 -0.000000 -0.000000 Pd\n-0.000000 0.000000 0.500000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500001 0.500000 -0.000000 Pd\n0.825016 0.627824 0.350879 O\n0.723058 0.325015 0.850880 O\n0.127823 0.025866 0.850880 O\n0.525866 0.223058 0.350880 O\n0.174986 0.372177 0.649120 O\n0.276943 0.674986 0.149120 O\n0.474135 0.776943 0.649119 O\n0.872178 0.974135 0.149119 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Pr",
"Pd",
"O"
],
"chemical_system": "O-Pd-Pr",
"density": 7.665828974039864,
"density_atomic": 0.07735645300047239,
"volume": 180.98037664568858,
"volume_molar": 7.784923592558238,
"formula_full": "Pr2 Pd4 O8",
"formula_reduced": "Pr(PdO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.14013075,
"spacegroup": 88
},
{
"id": "jvasp-40065",
"created_at": "2022-09-04T14:37:44.114832Z",
"updated_at": "2022-09-04T14:37:44.114865Z",
"structure_string": "Tl1 Cd1 Rh2\n1.0\n0.000000 3.259225 3.259225\n3.259225 0.000000 3.259225\n3.259225 3.259225 0.000000\nTl Cd Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Tl\n0.249999 0.249999 0.249999 Cd\n0.000000 0.000000 0.000000 Rh\n0.500001 0.500001 0.500001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"Cd",
"Rh"
],
"chemical_system": "Cd-Rh-Tl",
"density": 12.53285118214037,
"density_atomic": 0.05776795143031584,
"volume": 69.24254540729402,
"volume_molar": 10.424708875585402,
"formula_full": "Tl1 Cd1 Rh2",
"formula_reduced": "TlCdRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8064420875,
"spacegroup": 225
},
{
"id": "jvasp-40334",
"created_at": "2022-09-04T14:37:44.141078Z",
"updated_at": "2022-09-04T14:37:44.141096Z",
"structure_string": "Sc2 Zn1 Ir1\n1.0\n-0.000000 3.268242 3.268242\n3.268242 -0.000000 3.268242\n3.268242 3.268242 0.000000\nSc Zn Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.750000 0.750000 0.750000 Zn\n0.250001 0.250001 0.250001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Zn",
"Ir"
],
"chemical_system": "Ir-Sc-Zn",
"density": 8.265679451165683,
"density_atomic": 0.05729112828785069,
"volume": 69.81883791679925,
"volume_molar": 10.511471740864758,
"formula_full": "Sc2 Zn1 Ir1",
"formula_reduced": "Sc2ZnIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.860268,
"spacegroup": 225
},
{
"id": "jvasp-23902",
"created_at": "2022-09-04T14:37:41.750043Z",
"updated_at": "2022-09-04T14:37:41.750084Z",
"structure_string": "Si6 Bi8 O24\n1.0\n8.450712 -0.000000 -2.987778\n-4.225356 7.318531 -2.987778\n0.000000 0.000000 8.963334\nSi Bi O\n6 8 24\ndirect\n0.250000 0.625000 0.375000 Si\n0.625000 0.375000 0.250000 Si\n0.375000 0.250000 0.625000 Si\n0.749999 0.875000 0.124999 Si\n0.125000 0.750000 0.874999 Si\n0.875000 0.125000 0.749999 Si\n0.161348 0.161348 0.161348 Bi\n0.500000 -0.000000 0.338651 Bi\n0.500000 -0.000000 0.838651 Bi\n0.838651 0.500000 -0.000000 Bi\n-0.000000 0.838652 0.499999 Bi\n-0.000000 0.338652 0.500000 Bi\n0.338651 0.500000 -0.000000 Bi\n0.661348 0.661348 0.661348 Bi\n0.429764 0.771087 0.580718 O\n0.309631 0.658678 0.228912 O\n0.658678 0.228913 0.309631 O\n0.809631 0.728913 0.158678 O\n0.349046 0.190369 0.419281 O\n0.150954 0.570236 0.841321 O\n0.341322 0.070236 0.650954 O\n0.070235 0.650954 0.341321 O\n0.580718 0.429764 0.771087 O\n0.728913 0.158678 0.809631 O\n0.228913 0.309631 0.658678 O\n0.271087 0.929764 0.080718 O\n0.650954 0.341322 0.070235 O\n0.841322 0.150954 0.570235 O\n0.158678 0.809631 0.728912 O\n0.771087 0.580718 0.429764 O\n0.919281 0.690369 0.849045 O\n0.190368 0.419282 0.349046 O\n0.690368 0.849046 0.919281 O\n0.929764 0.080718 0.271087 O\n0.849045 0.919281 0.690368 O\n0.419281 0.349046 0.190368 O\n0.080718 0.271087 0.929764 O\n0.570235 0.841322 0.150954 O\n",
"nsites": 38,
"nelements": 3,
"elements": [
"Si",
"Bi",
"O"
],
"chemical_system": "Bi-O-Si",
"density": 6.662908095622086,
"density_atomic": 0.0685483173760683,
"volume": 554.3535050105638,
"volume_molar": 8.785249573613108,
"formula_full": "Si6 Bi8 O24",
"formula_reduced": "Si3(BiO3)4",
"formula_anonymous": "A3B4C12",
"energy_above_hull": 2.668661315789473,
"spacegroup": 220
},
{
"id": "jvasp-23869",
"created_at": "2022-09-04T14:37:41.769067Z",
"updated_at": "2022-09-04T14:37:41.769095Z",
"structure_string": "Bi4 Pd6 S4\n1.0\n6.889098 -0.000000 -2.435664\n-3.444548 5.966134 -2.435664\n0.000000 0.000000 7.306992\nBi Pd S\n4 6 4\ndirect\n0.492221 0.500000 0.000000 Bi\n0.500000 0.000000 0.492222 Bi\n-0.000000 0.492221 0.500000 Bi\n0.007778 0.007778 0.007778 Bi\n0.250000 0.530138 0.280139 Pd\n0.969861 0.219861 0.750001 Pd\n0.219861 0.749999 0.969861 Pd\n0.530139 0.280139 0.250000 Pd\n0.280139 0.250000 0.530139 Pd\n0.750000 0.969861 0.219862 Pd\n0.944508 0.500000 0.000001 S\n0.555492 0.555492 0.555492 S\n0.500000 -0.000000 0.944508 S\n-0.000001 0.944507 0.500000 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Bi",
"Pd",
"S"
],
"chemical_system": "Bi-Pd-S",
"density": 8.861510774384644,
"density_atomic": 0.04661589615138586,
"volume": 300.32673735445906,
"volume_molar": 12.918642045286445,
"formula_full": "Bi4 Pd6 S4",
"formula_reduced": "Bi2Pd3S2",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 1.6701865285714286,
"spacegroup": 199
},
{
"id": "jvasp-37252",
"created_at": "2022-09-04T14:37:41.786011Z",
"updated_at": "2022-09-04T14:37:41.786034Z",
"structure_string": "Sm1 Er1 In2\n1.0\n-0.000000 3.760731 3.760731\n3.760731 0.000000 3.760731\n3.760731 3.760731 0.000000\nSm Er In\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sm\n0.249999 0.249999 0.249999 Er\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Er",
"In"
],
"chemical_system": "Er-In-Sm",
"density": 8.542638524218711,
"density_atomic": 0.037602193984465765,
"volume": 106.37677156956538,
"volume_molar": 16.01539729965722,
"formula_full": "Sm1 Er1 In2",
"formula_reduced": "SmErIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3586272037499999,
"spacegroup": 225
},
{
"id": "jvasp-41456",
"created_at": "2022-09-04T14:37:41.797939Z",
"updated_at": "2022-09-04T14:37:41.797969Z",
"structure_string": "Tm2 Al1 Os1\n1.0\n0.000000 3.442506 3.442506\n3.442506 -0.000000 3.442506\n3.442506 3.442506 -0.000000\nTm Al Os\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Tm\n0.000000 0.000000 0.000000 Tm\n0.250000 0.250000 0.250000 Al\n0.750001 0.750001 0.750001 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Al",
"Os"
],
"chemical_system": "Al-Os-Tm",
"density": 11.296672319072517,
"density_atomic": 0.04902367653131846,
"volume": 81.59322766101857,
"volume_molar": 12.284147550934486,
"formula_full": "Tm2 Al1 Os1",
"formula_reduced": "Tm2AlOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4829765750000004,
"spacegroup": 225
},
{
"id": "jvasp-41939",
"created_at": "2022-09-04T14:37:41.813364Z",
"updated_at": "2022-09-04T14:37:41.813384Z",
"structure_string": "La1 Ga1 Au2\n1.0\n0.000000 3.566825 3.566825\n3.566825 0.000000 3.566825\n3.566825 3.566825 0.000000\nLa Ga Au\n1 1 2\ndirect\n0.750000 0.750000 0.750000 La\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Ga",
"Au"
],
"chemical_system": "Au-Ga-La",
"density": 11.024912547188524,
"density_atomic": 0.044074215394621453,
"volume": 90.75601151797555,
"volume_molar": 13.66363690443575,
"formula_full": "La1 Ga1 Au2",
"formula_reduced": "LaGaAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.40350811625,
"spacegroup": 225
},
{
"id": "jvasp-50053",
"created_at": "2022-09-04T14:37:41.814615Z",
"updated_at": "2022-09-04T14:37:41.814643Z",
"structure_string": "Na2 Li2 O2\n1.0\n1.653499 -2.864547 0.000000\n0.000000 -5.729094 0.000000\n0.000000 0.000000 -6.657755\nNa Li O\n2 2 2\ndirect\n0.502181 0.498910 0.000000 Na\n0.502181 0.498910 0.500000 Na\n0.502170 0.832183 0.749999 Li\n0.502170 0.165648 0.250000 Li\n0.502163 0.832346 0.250000 O\n0.502163 0.165490 0.749999 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Li",
"O"
],
"chemical_system": "Li-Na-O",
"density": 2.4185743638367616,
"density_atomic": 0.09513351784397636,
"volume": 63.06925399143017,
"volume_molar": 6.3301987527430725,
"formula_full": "Na2 Li2 O2",
"formula_reduced": "NaLiO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1533141666666666,
"spacegroup": 194
},
{
"id": "jvasp-23849",
"created_at": "2022-09-04T14:37:41.843847Z",
"updated_at": "2022-09-04T14:37:41.843878Z",
"structure_string": "Sm4 Mn4 B16\n1.0\n3.497428 0.000000 0.000000\n0.000000 5.957526 -0.000000\n0.000000 -0.000000 11.524372\nSm Mn B\n4 4 16\ndirect\n0.000000 0.376494 0.651045 Sm\n0.000000 0.623507 0.348955 Sm\n0.000000 0.876494 0.848955 Sm\n0.000000 0.123506 0.151045 Sm\n0.000000 0.376426 0.918165 Mn\n0.000000 0.623574 0.081834 Mn\n0.000000 0.876427 0.581834 Mn\n0.000000 0.123574 0.418166 Mn\n0.500000 0.641638 0.532759 B\n0.500000 0.358363 0.467241 B\n0.500000 0.222764 0.818014 B\n0.500000 0.777237 0.181986 B\n0.500000 0.722764 0.681986 B\n0.500000 0.277236 0.318014 B\n0.500000 0.111374 0.545569 B\n0.500000 0.475418 0.188841 B\n0.500000 0.611375 0.954431 B\n0.500000 0.388626 0.045569 B\n0.500000 0.858363 0.032759 B\n0.500000 0.524582 0.811159 B\n0.500000 0.975419 0.311159 B\n0.500000 0.024582 0.688841 B\n0.500000 0.888626 0.454431 B\n0.500000 0.141637 0.967241 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sm",
"Mn",
"B"
],
"chemical_system": "B-Mn-Sm",
"density": 6.875067374854616,
"density_atomic": 0.09994918199091679,
"volume": 240.1220252325935,
"volume_molar": 6.025202648028957,
"formula_full": "Sm4 Mn4 B16",
"formula_reduced": "SmMnB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.281686074952108,
"spacegroup": 55
},
{
"id": "jvasp-13970",
"created_at": "2022-09-04T14:37:41.850995Z",
"updated_at": "2022-09-04T14:37:41.851009Z",
"structure_string": "U2 Si2 S2\n1.0\n4.108459 0.000000 0.000000\n0.000000 4.108459 -0.000000\n0.000000 -0.000000 7.230342\nU Si S\n2 2 2\ndirect\n0.500000 0.000000 0.754029 U\n0.000000 0.500000 0.245971 U\n0.500000 0.000000 0.367265 Si\n0.000000 0.500000 0.632735 Si\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.000000 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Si",
"S"
],
"chemical_system": "S-Si-U",
"density": 8.114093154597667,
"density_atomic": 0.04916256068817027,
"volume": 122.04409038123494,
"volume_molar": 12.249444853365983,
"formula_full": "U2 Si2 S2",
"formula_reduced": "USiS",
"formula_anonymous": "ABC",
"energy_above_hull": 3.102504866666666,
"spacegroup": 129
}
]
}