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=-nsites&page=1300",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=1298",
"results": [
{
"id": "jvasp-21896",
"created_at": "2022-09-04T14:37:49.085710Z",
"updated_at": "2022-09-04T14:37:49.085742Z",
"structure_string": "Hf4 Si4 Rh4\n1.0\n3.924882 -0.000000 0.000000\n0.000000 6.516946 0.000000\n0.000000 0.000000 7.458977\nHf Si Rh\n4 4 4\ndirect\n0.250000 0.520498 0.184705 Hf\n0.750000 0.479502 0.815296 Hf\n0.250000 0.020498 0.315296 Hf\n0.750000 0.979503 0.684705 Hf\n0.250000 0.772635 0.883118 Si\n0.750000 0.227366 0.116882 Si\n0.250000 0.272634 0.616882 Si\n0.750000 0.727366 0.383118 Si\n0.750000 0.849793 0.066663 Rh\n0.250000 0.150208 0.933338 Rh\n0.750000 0.349792 0.433337 Rh\n0.250000 0.650208 0.566663 Rh\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Hf",
"Si",
"Rh"
],
"chemical_system": "Hf-Rh-Si",
"density": 10.774399771343441,
"density_atomic": 0.06289719115224994,
"volume": 190.78753407211158,
"volume_molar": 9.574578211962933,
"formula_full": "Hf4 Si4 Rh4",
"formula_reduced": "HfSiRh",
"formula_anonymous": "ABC",
"energy_above_hull": 3.072124866666667,
"spacegroup": 62
},
{
"id": "jvasp-39095",
"created_at": "2022-09-04T14:37:49.073133Z",
"updated_at": "2022-09-04T14:37:49.073155Z",
"structure_string": "Si4 O8\n1.0\n0.000000 4.898603 0.089634\n8.161381 0.000000 0.000000\n0.000000 -2.364096 -4.484313\nSi O\n4 8\ndirect\n0.556059 0.937723 0.327096 Si\n0.770183 0.563965 0.325395 Si\n0.443939 0.437723 0.672904 Si\n0.229816 0.063965 0.674605 Si\n0.424606 0.944376 0.566935 O\n0.651089 0.750842 0.302495 O\n0.141158 0.556953 0.564756 O\n0.717145 0.501241 0.998788 O\n0.575393 0.444376 0.433065 O\n0.348909 0.250842 0.697505 O\n0.858841 0.056954 0.435244 O\n0.282854 0.001241 0.001212 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.247750166347132,
"density_atomic": 0.06758638063387785,
"volume": 177.55056399609848,
"volume_molar": 8.910287403349109,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3925218666666668,
"spacegroup": 20
},
{
"id": "jvasp-23767",
"created_at": "2022-09-04T14:37:41.113089Z",
"updated_at": "2022-09-04T14:37:41.113115Z",
"structure_string": "Pr4 Zn4 Sn4\n1.0\n2.292926 -3.971465 -0.000000\n2.292926 3.971465 0.000000\n-0.000000 0.000000 16.732462\nPr Zn Sn\n4 4 4\ndirect\n0.000000 0.000000 0.750000 Pr\n0.000000 0.000000 0.250000 Pr\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.666668 0.333334 0.842798 Zn\n0.666668 0.333334 0.657201 Zn\n0.333334 0.666668 0.157201 Zn\n0.333334 0.666668 0.342799 Zn\n0.666668 0.333334 0.115260 Sn\n0.666668 0.333334 0.384740 Sn\n0.333334 0.666668 0.884740 Sn\n0.333334 0.666668 0.615260 Sn\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Pr",
"Zn",
"Sn"
],
"chemical_system": "Pr-Sn-Zn",
"density": 7.084308073784809,
"density_atomic": 0.039377725262479166,
"volume": 304.74081273135727,
"volume_molar": 15.293267246541948,
"formula_full": "Pr4 Zn4 Sn4",
"formula_reduced": "PrZnSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-23836",
"created_at": "2022-09-04T14:37:41.210591Z",
"updated_at": "2022-09-04T14:37:41.210616Z",
"structure_string": "Ho4 Ge4 Rh4\n1.0\n4.304178 0.000000 0.000000\n0.000000 6.886195 0.000000\n0.000000 0.000000 7.539282\nHo Ge Rh\n4 4 4\ndirect\n0.250000 0.501890 0.696103 Ho\n0.750000 0.498111 0.303897 Ho\n0.250000 0.001890 0.803897 Ho\n0.750000 0.998111 0.196103 Ho\n0.250000 0.287504 0.103960 Ge\n0.750000 0.712497 0.896040 Ge\n0.250000 0.787504 0.396040 Ge\n0.750000 0.212496 0.603960 Ge\n0.750000 0.840974 0.569696 Rh\n0.250000 0.159026 0.430304 Rh\n0.750000 0.340974 0.930304 Rh\n0.250000 0.659027 0.069696 Rh\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ho",
"Ge",
"Rh"
],
"chemical_system": "Ge-Ho-Rh",
"density": 10.12035705948179,
"density_atomic": 0.053700919003341334,
"volume": 223.4598629355551,
"volume_molar": 11.214222906735163,
"formula_full": "Ho4 Ge4 Rh4",
"formula_reduced": "HoGeRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1789581722222222,
"spacegroup": 62
},
{
"id": "jvasp-56280",
"created_at": "2022-09-04T14:37:48.830086Z",
"updated_at": "2022-09-04T14:37:48.830114Z",
"structure_string": "Pr4 I8\n1.0\n7.601239 0.000000 4.388577\n2.533746 7.166517 4.388577\n-0.000000 0.000000 8.777155\nPr I\n4 8\ndirect\n0.363129 0.363129 0.363129 Pr\n0.363129 0.910613 0.363129 Pr\n0.363129 0.363129 0.910612 Pr\n0.910613 0.363129 0.363129 Pr\n0.627394 0.627394 0.627393 I\n0.110694 0.667920 0.110694 I\n0.627394 0.117819 0.627393 I\n0.117820 0.627394 0.627393 I\n0.667920 0.110694 0.110694 I\n0.110694 0.110694 0.110694 I\n0.627394 0.627394 0.117819 I\n0.110694 0.110694 0.667919 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Pr",
"I"
],
"chemical_system": "I-Pr",
"density": 5.483377906209691,
"density_atomic": 0.025097759587110656,
"volume": 478.1303270656392,
"volume_molar": 23.994734426784312,
"formula_full": "Pr4 I8",
"formula_reduced": "PrI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0009088722222223,
"spacegroup": 216
},
{
"id": "jvasp-21904",
"created_at": "2022-09-04T14:37:49.580068Z",
"updated_at": "2022-09-04T14:37:49.580089Z",
"structure_string": "Ce2 Al8 Co2\n1.0\n4.045854 0.000000 0.000000\n0.000000 6.807295 0.000000\n0.000000 -0.000000 7.626644\nCe Al Co\n2 8 2\ndirect\n0.000000 0.616863 0.750000 Ce\n0.000000 0.383136 0.250000 Ce\n0.499999 0.305165 0.568921 Al\n0.499999 0.694835 0.431079 Al\n0.499999 0.305165 0.931078 Al\n0.499999 0.694835 0.068921 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.499999 0.045319 0.250000 Al\n0.499999 0.954682 0.750000 Al\n0.000000 0.194656 0.750000 Co\n0.000000 0.805343 0.250000 Co\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ce",
"Al",
"Co"
],
"chemical_system": "Al-Ce-Co",
"density": 4.853604031307449,
"density_atomic": 0.0571298380871318,
"volume": 210.04785593297416,
"volume_molar": 10.541147956371429,
"formula_full": "Ce2 Al8 Co2",
"formula_reduced": "CeAl4Co",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.174746266666667,
"spacegroup": 51
},
{
"id": "jvasp-28864",
"created_at": "2022-09-04T14:37:41.148625Z",
"updated_at": "2022-09-04T14:37:41.148645Z",
"structure_string": "Mo1 W3 Se6 S2\n1.0\n3.291672 -0.000000 -0.000004\n-1.645836 2.850669 -0.000011\n-0.000052 0.000019 34.584125\nMo W Se S\n1 3 6 2\ndirect\n0.666666 0.333334 0.284763 Mo\n0.333306 0.666617 0.092944 W\n0.333333 0.666667 0.469906 W\n0.666692 0.333380 0.655303 W\n0.333338 0.666677 0.333500 Se\n0.333358 0.666708 0.704283 Se\n0.666629 0.333265 0.043964 Se\n0.666652 0.333306 0.141989 Se\n0.333328 0.666662 0.236017 Se\n0.333362 0.666721 0.606275 Se\n0.666671 0.333347 0.425301 S\n0.666663 0.333321 0.514508 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 6.065345757833208,
"density_atomic": 0.03697780327265013,
"volume": 324.5190070248319,
"volume_molar": 16.28582616332472,
"formula_full": "Mo1 W3 Se6 S2",
"formula_reduced": "MoW3(Se3S)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 4.207748841666667,
"spacegroup": 156
},
{
"id": "jvasp-88542",
"created_at": "2022-09-04T14:37:41.160997Z",
"updated_at": "2022-09-04T14:37:41.161017Z",
"structure_string": "Ca2 W2 O8\n1.0\n4.862093 0.000327 -2.036224\n-0.852642 4.786721 -2.036430\n-0.006190 -0.007684 6.807398\nCa W O\n2 2 8\ndirect\n0.624997 0.875001 0.249994 Ca\n0.375002 0.125001 0.750007 Ca\n0.125008 0.375016 0.250014 W\n0.874990 0.624988 0.749988 W\n0.718895 0.866800 0.923258 O\n0.056471 0.218913 0.423267 O\n0.366796 0.704342 0.423259 O\n0.204344 0.556475 0.923263 O\n0.795656 0.443527 0.076740 O\n0.633205 0.295659 0.576743 O\n0.281104 0.133201 0.076743 O\n0.943529 0.781088 0.576735 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"W",
"O"
],
"chemical_system": "Ca-O-W",
"density": 6.040978028146332,
"density_atomic": 0.07581309250239267,
"volume": 158.28400615132907,
"volume_molar": 7.943404709166746,
"formula_full": "Ca2 W2 O8",
"formula_reduced": "CaWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.6868890700000003,
"spacegroup": 88
},
{
"id": "jvasp-28734",
"created_at": "2022-09-04T14:37:41.214814Z",
"updated_at": "2022-09-04T14:37:41.214834Z",
"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.350211 0.000025 0.000089\n-1.675085 2.901314 -0.000326\n0.000946 -0.003393 36.148160\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.666635 0.333225 0.414596 Te\n0.666738 0.333527 0.520302 Te\n0.333298 0.666605 0.099801 Mo\n0.666682 0.333375 0.274883 Mo\n0.333362 0.666712 0.467463 W\n0.666652 0.333282 0.660798 W\n0.333384 0.666819 0.320955 Se\n0.333382 0.666787 0.707062 Se\n0.333330 0.666616 0.228791 Se\n0.333292 0.666512 0.614458 Se\n0.666588 0.333148 0.057852 S\n0.666661 0.333379 0.141785 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.646299486443133,
"density_atomic": 0.034152797996762685,
"volume": 351.36213440367226,
"volume_molar": 17.632935259274607,
"formula_full": "Te2 Mo2 W2 Se4 S2",
"formula_reduced": "TeMoWSe2S",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.532421733333334,
"spacegroup": 156
},
{
"id": "jvasp-23770",
"created_at": "2022-09-04T14:37:41.258125Z",
"updated_at": "2022-09-04T14:37:41.258147Z",
"structure_string": "Zr4 V4 P4\n1.0\n3.527041 0.000000 0.000000\n0.000000 6.640679 0.000000\n0.000000 0.000000 7.935538\nZr V P\n4 4 4\ndirect\n0.250000 0.540922 0.669175 Zr\n0.750000 0.459078 0.330825 Zr\n0.250000 0.040922 0.830826 Zr\n0.750000 0.959078 0.169175 Zr\n0.750000 0.872294 0.556904 V\n0.250000 0.127706 0.443098 V\n0.750000 0.372294 0.943097 V\n0.250000 0.627706 0.056903 V\n0.250000 0.260129 0.136927 P\n0.750000 0.739871 0.863073 P\n0.250000 0.760129 0.363073 P\n0.750000 0.239871 0.636927 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zr",
"V",
"P"
],
"chemical_system": "P-V-Zr",
"density": 6.187358490212863,
"density_atomic": 0.06456272830859056,
"volume": 185.86575125269775,
"volume_molar": 9.327580970890768,
"formula_full": "Zr4 V4 P4",
"formula_reduced": "ZrVP",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0776314,
"spacegroup": 62
},
{
"id": "jvasp-48471",
"created_at": "2022-09-04T14:37:41.274536Z",
"updated_at": "2022-09-04T14:37:41.274565Z",
"structure_string": "Na4 V2 O6\n1.0\n2.652907 4.594619 -0.005360\n-2.652907 4.594619 0.005360\n-1.813738 0.000000 5.339552\nNa V O\n4 2 6\ndirect\n0.157682 0.157683 0.500000 Na\n0.842317 0.842318 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.667595 0.667595 0.000000 V\n0.332405 0.332405 0.000000 V\n0.308858 0.691142 0.797571 O\n0.068535 0.552708 0.200259 O\n0.447292 0.931465 0.200259 O\n0.931465 0.447292 0.799742 O\n0.552708 0.068535 0.799742 O\n0.691142 0.308858 0.202429 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"V",
"O"
],
"chemical_system": "Na-O-V",
"density": 3.699959313513885,
"density_atomic": 0.09225141956868003,
"volume": 130.0792991165426,
"volume_molar": 6.527965410349694,
"formula_full": "Na4 V2 O6",
"formula_reduced": "Na2VO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5072987833333331,
"spacegroup": 12
},
{
"id": "jvasp-25275",
"created_at": "2022-09-04T14:37:48.889417Z",
"updated_at": "2022-09-04T14:37:48.889431Z",
"structure_string": "C12\n1.0\n2.520883 -0.000000 0.000000\n-1.260441 2.183148 -0.000000\n0.000000 -0.000000 12.433786\nC\n12\ndirect\n0.666667 0.333333 0.354938 C\n0.333333 0.666668 0.854938 C\n0.666667 0.333333 0.020763 C\n0.333333 0.666668 0.645062 C\n0.333333 0.666668 0.979237 C\n0.000000 0.000000 0.686848 C\n0.666667 0.333333 0.479237 C\n0.333333 0.666668 0.520763 C\n0.000000 0.000000 0.313152 C\n0.666667 0.333333 0.145062 C\n0.000000 0.000000 0.813153 C\n0.000000 0.000000 0.186848 C\n",
"nsites": 12,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.497513557297501,
"density_atomic": 0.1753646245375593,
"volume": 68.42885235060541,
"volume_molar": 3.4340681741716885,
"formula_full": "C12",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.1092399999999997,
"spacegroup": 194
}
]
}