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=-created_at&page=4485",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=4483",
"results": [
{
"id": "jvasp-98027",
"created_at": "2022-09-04T14:35:45.969529Z",
"updated_at": "2022-09-04T14:35:45.969554Z",
"structure_string": "Li3 B3 Pt9\n1.0\n9.336740 0.000000 0.000000\n-4.668370 8.085854 -0.000000\n-0.000000 0.000000 2.808512\nLi B Pt\n3 3 9\ndirect\n-0.000000 0.362203 0.000000 Li\n0.637797 0.637797 0.000000 Li\n0.362203 -0.000000 0.000000 Li\n0.000000 0.000000 0.500000 B\n0.666667 0.333333 0.000000 B\n0.333333 0.666666 0.000000 B\n0.681804 0.165137 0.500000 Pt\n0.483334 0.318196 0.500000 Pt\n0.834862 0.516666 0.500000 Pt\n0.165137 0.681803 0.500000 Pt\n0.318196 0.483334 0.500000 Pt\n0.516666 0.834862 0.500000 Pt\n-0.000000 0.822601 0.000000 Pt\n0.177399 0.177399 0.000000 Pt\n0.822601 -0.000000 0.000000 Pt\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Li",
"B",
"Pt"
],
"chemical_system": "B-Li-Pt",
"density": 14.167496069747749,
"density_atomic": 0.07074468459434102,
"volume": 212.03006396893136,
"volume_molar": 8.512499270484726,
"formula_full": "Li3 B3 Pt9",
"formula_reduced": "LiBPt3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.675139356666667,
"spacegroup": 189
},
{
"id": "jvasp-70446",
"created_at": "2022-09-04T14:35:45.967181Z",
"updated_at": "2022-09-04T14:35:45.967204Z",
"structure_string": "Be2 Os1 Cl1\n1.0\n-1.588761 1.588761 5.276702\n1.588761 -1.588761 5.276702\n1.588761 1.588761 -5.276702\nBe Os Cl\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.750000 0.250000 0.500000 Os\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Os",
"Cl"
],
"chemical_system": "Be-Cl-Os",
"density": 7.595879197554535,
"density_atomic": 0.07507931313792754,
"volume": 53.27699246064805,
"volume_molar": 8.021038696687034,
"formula_full": "Be2 Os1 Cl1",
"formula_reduced": "Be2OsCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.592647816875,
"spacegroup": 119
},
{
"id": "jvasp-87103",
"created_at": "2022-09-04T14:35:45.964579Z",
"updated_at": "2022-09-04T14:35:45.964603Z",
"structure_string": "Ho2 Co2 Si4\n1.0\n3.974133 0.000000 -0.000000\n-0.000000 3.895700 -0.954267\n0.000000 -0.007839 8.397036\nHo Co Si\n2 2 4\ndirect\n0.250000 0.892205 0.784411 Ho\n0.749999 0.107795 0.215589 Ho\n0.250000 0.678604 0.357206 Co\n0.749999 0.321396 0.642794 Co\n0.749999 0.750058 0.500117 Si\n0.250000 0.249941 0.499883 Si\n0.749999 0.457332 0.914664 Si\n0.250000 0.542668 0.085336 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ho",
"Co",
"Si"
],
"chemical_system": "Co-Ho-Si",
"density": 7.155435341911827,
"density_atomic": 0.06155103965375566,
"volume": 129.9734341613491,
"volume_molar": 9.78397894475296,
"formula_full": "Ho2 Co2 Si4",
"formula_reduced": "HoCoSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5472934166666663,
"spacegroup": 63
},
{
"id": "jvasp-15606",
"created_at": "2022-09-04T14:35:45.962472Z",
"updated_at": "2022-09-04T14:35:45.962498Z",
"structure_string": "Y3 Mg3 Ga3\n1.0\n3.634379 -6.294929 -0.000000\n3.634379 6.294929 0.000000\n0.000000 0.000000 4.399283\nY Mg Ga\n3 3 3\ndirect\n0.423808 0.000000 0.500000 Y\n0.576193 0.576193 0.500000 Y\n0.000000 0.423808 0.500000 Y\n0.755683 0.000000 0.000000 Mg\n0.244317 0.244317 0.000000 Mg\n0.000000 0.755683 0.000000 Mg\n0.333333 0.666667 0.000000 Ga\n0.666667 0.333333 0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Y",
"Mg",
"Ga"
],
"chemical_system": "Ga-Mg-Y",
"density": 4.5272187555358645,
"density_atomic": 0.04471050372564297,
"volume": 201.2949810457671,
"volume_molar": 13.469185668212683,
"formula_full": "Y3 Mg3 Ga3",
"formula_reduced": "YMgGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2978889416666666,
"spacegroup": 189
},
{
"id": "jvasp-62986",
"created_at": "2022-09-04T14:35:45.961380Z",
"updated_at": "2022-09-04T14:35:45.961416Z",
"structure_string": "Nd2 Sn2 Au2\n1.0\n2.385259 -4.131390 -0.000000\n2.384998 4.131239 -0.000000\n0.000000 -0.000000 7.680381\nNd Sn Au\n2 2 2\ndirect\n0.999973 0.999946 0.753836 Nd\n0.000027 0.000055 0.253836 Nd\n0.666661 0.333322 0.478370 Sn\n0.333339 0.666679 0.978370 Sn\n0.666694 0.333387 0.069994 Au\n0.333307 0.666613 0.569994 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Sn",
"Au"
],
"chemical_system": "Au-Nd-Sn",
"density": 10.091302817099654,
"density_atomic": 0.03964043863427478,
"volume": 151.36058547072054,
"volume_molar": 15.191912520344834,
"formula_full": "Nd2 Sn2 Au2",
"formula_reduced": "NdSnAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.44988359,
"spacegroup": 186
},
{
"id": "jvasp-67435",
"created_at": "2022-09-04T14:35:45.958677Z",
"updated_at": "2022-09-04T14:35:45.958698Z",
"structure_string": "Sc1 Be2 Rh1\n1.0\n2.965380 0.000000 0.000000\n0.000000 2.965380 -0.000000\n-0.000000 -0.000000 6.010529\nSc Be Rh\n1 2 1\ndirect\n0.500000 0.500000 0.743263 Sc\n0.000000 0.000000 0.062638 Be\n0.500000 0.500000 0.248460 Be\n0.000000 0.000000 0.445639 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Rh"
],
"chemical_system": "Be-Rh-Sc",
"density": 5.211765191848326,
"density_atomic": 0.07568095194424711,
"volume": 52.853457801994,
"volume_molar": 7.9572740634082,
"formula_full": "Sc1 Be2 Rh1",
"formula_reduced": "ScBe2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2099276125000005,
"spacegroup": 99
},
{
"id": "jvasp-71209",
"created_at": "2022-09-04T14:35:45.952545Z",
"updated_at": "2022-09-04T14:35:45.952565Z",
"structure_string": "Be1 Sb2 Pb1\n1.0\n3.851822 0.000000 -0.000000\n0.000000 3.851822 0.000000\n-0.000000 0.000000 7.330161\nBe Sb Pb\n1 2 1\ndirect\n0.000000 0.000000 0.328670 Be\n0.000000 0.000000 -0.004676 Sb\n0.500000 0.500000 0.380673 Sb\n0.500000 0.500000 0.795331 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sb",
"Pb"
],
"chemical_system": "Be-Pb-Sb",
"density": 7.019530595435649,
"density_atomic": 0.036780197675566347,
"volume": 108.7541735170516,
"volume_molar": 16.373323528928726,
"formula_full": "Be1 Sb2 Pb1",
"formula_reduced": "BeSb2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.40949728,
"spacegroup": 99
},
{
"id": "jvasp-86822",
"created_at": "2022-09-04T14:35:45.950647Z",
"updated_at": "2022-09-04T14:35:45.950666Z",
"structure_string": "Ba6 Al6 Ga4\n1.0\n5.970415 -0.000000 0.000000\n-2.985207 5.170531 -0.000000\n0.000000 -0.000000 14.728134\nBa Al Ga\n6 6 4\ndirect\n0.333333 0.666667 0.877781 Ba\n0.666667 0.333333 0.377781 Ba\n0.666667 0.333333 0.122219 Ba\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666667 0.622219 Ba\n0.000000 0.000000 0.500000 Ba\n0.841617 0.683234 0.750000 Al\n0.683234 0.841616 0.250000 Al\n0.841617 0.158383 0.750000 Al\n0.158383 0.841616 0.250000 Al\n0.316766 0.158383 0.750000 Al\n0.158383 0.316766 0.250000 Al\n0.666667 0.333333 0.888209 Ga\n0.333333 0.666667 0.111790 Ga\n0.333333 0.666667 0.388210 Ga\n0.666667 0.333333 0.611790 Ga\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Ga"
],
"chemical_system": "Al-Ba-Ga",
"density": 4.619171303859234,
"density_atomic": 0.03519107955003961,
"volume": 454.6606755058184,
"volume_molar": 17.112691162079514,
"formula_full": "Ba6 Al6 Ga4",
"formula_reduced": "Ba3Al3Ga2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.5021053937500001,
"spacegroup": 194
},
{
"id": "jvasp-85785",
"created_at": "2022-09-04T14:35:45.949475Z",
"updated_at": "2022-09-04T14:35:45.949499Z",
"structure_string": "K2 H4 I6 O2\n1.0\n4.110159 0.000000 -2.014820\n0.000000 9.992311 0.000000\n-0.014324 0.000000 9.396564\nK H I O\n2 4 6 2\ndirect\n0.023964 0.239149 0.616382 K\n0.023964 0.760851 0.116382 K\n0.738406 0.194063 0.874451 H\n0.738405 0.805937 0.374451 H\n0.707679 0.348730 0.846678 H\n0.707679 0.651270 0.346678 H\n0.342777 0.536402 0.909903 I\n0.342777 0.463598 0.409904 I\n0.376453 0.754507 0.699679 I\n0.376452 0.245493 0.199679 I\n0.394099 0.974621 0.489801 I\n0.394099 0.025379 0.989801 I\n0.689827 0.262819 0.792304 O\n0.689826 0.737181 0.292304 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"H",
"I",
"O"
],
"chemical_system": "H-I-K-O",
"density": 3.770618857189057,
"density_atomic": 0.03630438192653444,
"volume": 385.6283802966376,
"volume_molar": 16.587917051408297,
"formula_full": "K2 H4 I6 O2",
"formula_reduced": "KH2I3O",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 0.7970043321428577,
"spacegroup": 7
},
{
"id": "jvasp-42324",
"created_at": "2022-09-04T14:35:45.947328Z",
"updated_at": "2022-09-04T14:35:45.947346Z",
"structure_string": "Ca2 Fe1 P2 H8 O12\n1.0\n5.901683 0.033183 -0.010990\n1.583158 6.240589 0.035912\n1.403988 2.030254 6.404784\nCa Fe P H O\n2 1 2 8 12\ndirect\n0.703658 0.664517 0.791178 Ca\n0.296343 0.335482 0.208821 Ca\n0.000000 0.000000 0.000000 Fe\n0.774176 0.562140 0.284564 P\n0.225825 0.437859 0.715435 P\n0.770104 0.171259 0.291829 H\n0.821640 0.143992 0.623559 H\n0.624904 0.167772 0.809993 H\n0.322468 0.061277 0.672994 H\n0.178360 0.856008 0.376440 H\n0.229896 0.828740 0.708170 H\n0.677533 0.938723 0.327005 H\n0.375096 0.832227 0.190006 H\n0.759854 0.053530 0.768651 O\n0.309328 0.905864 0.775354 O\n0.240147 0.946469 0.231348 O\n0.680953 0.681315 0.452509 O\n0.979941 0.668471 0.127537 O\n0.113181 0.690710 0.622422 O\n0.425940 0.407732 0.845966 O\n0.574060 0.592267 0.154033 O\n0.886820 0.309289 0.377577 O\n0.020059 0.331528 0.872462 O\n0.319048 0.318684 0.547490 O\n0.690672 0.094135 0.224645 O\n",
"nsites": 25,
"nelements": 5,
"elements": [
"Ca",
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Ca-Fe-H-O-P",
"density": 2.8101519924292897,
"density_atomic": 0.10629977948994451,
"volume": 235.18393095410784,
"volume_molar": 5.665242946783035,
"formula_full": "Ca2 Fe1 P2 H8 O12",
"formula_reduced": "Ca2FeP2(H2O3)4",
"formula_anonymous": "AB2C2D8E12",
"energy_above_hull": 2.8904347736000005,
"spacegroup": 2
},
{
"id": "jvasp-66289",
"created_at": "2022-09-04T14:35:45.947216Z",
"updated_at": "2022-09-04T14:35:45.947247Z",
"structure_string": "Ba1 Bi1 Mo1\n1.0\n-0.000000 3.929077 3.929077\n3.929077 0.000000 3.929077\n3.929077 3.929077 0.000000\nBa Bi Mo\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 Mo\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Mo"
],
"chemical_system": "Ba-Bi-Mo",
"density": 6.053586747870644,
"density_atomic": 0.024729745055242315,
"volume": 121.31140023071315,
"volume_molar": 24.351810932735034,
"formula_full": "Ba1 Bi1 Mo1",
"formula_reduced": "BaBiMo",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3806420566666664,
"spacegroup": 216
},
{
"id": "jvasp-98226",
"created_at": "2022-09-04T14:35:45.943333Z",
"updated_at": "2022-09-04T14:35:45.943364Z",
"structure_string": "Rb16 Bi16\n1.0\n7.508875 0.000000 0.000000\n0.000000 12.800956 -5.539353\n0.000000 -0.078617 14.806529\nRb Bi\n16 16\ndirect\n0.131515 0.550201 0.847566 Rb\n0.629856 0.359391 0.880602 Rb\n0.870143 0.859392 0.880602 Rb\n0.370143 0.640609 0.119398 Rb\n0.301427 0.033508 0.394197 Rb\n0.801427 0.466492 0.605803 Rb\n0.698572 0.966492 0.605803 Rb\n0.198572 0.533508 0.394197 Rb\n0.129856 0.140609 0.119398 Rb\n0.575417 0.311556 0.344437 Rb\n0.924582 0.811556 0.344437 Rb\n0.424583 0.688444 0.655564 Rb\n0.368484 0.050201 0.847566 Rb\n0.868484 0.449799 0.152434 Rb\n0.631515 0.949799 0.152434 Rb\n0.075417 0.188444 0.655563 Rb\n0.354187 0.816926 0.928207 Bi\n0.854187 0.683075 0.071793 Bi\n0.382802 0.365635 0.109863 Bi\n0.882802 0.134365 0.890137 Bi\n0.617197 0.634365 0.890137 Bi\n0.117197 0.865635 0.109863 Bi\n0.065846 0.269786 0.393977 Bi\n0.434153 0.769787 0.393977 Bi\n0.934153 0.730214 0.606023 Bi\n0.296603 0.384822 0.577195 Bi\n0.796603 0.115178 0.422805 Bi\n0.703396 0.615178 0.422805 Bi\n0.203396 0.884823 0.577195 Bi\n0.145812 0.316926 0.928207 Bi\n0.565846 0.230213 0.606023 Bi\n0.645812 0.183074 0.071793 Bi\n",
"nsites": 32,
"nelements": 2,
"elements": [
"Rb",
"Bi"
],
"chemical_system": "Bi-Rb",
"density": 5.509427067644849,
"density_atomic": 0.02253608296452627,
"volume": 1419.9450743223988,
"volume_molar": 26.722215965744212,
"formula_full": "Rb16 Bi16",
"formula_reduced": "RbBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.1535347666666666,
"spacegroup": 14
}
]
}