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=-formula_anonymous&page=4058",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=4056",
"results": [
{
"id": "jvasp-1112",
"created_at": "2022-09-04T14:37:03.996668Z",
"updated_at": "2022-09-04T14:37:03.996696Z",
"structure_string": "Pb1 S1\n1.0\n3.664950 0.000000 2.115960\n1.221650 3.455348 2.115960\n0.000000 0.000000 4.231920\nPb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.413631154735488,
"density_atomic": 0.03731923212502215,
"volume": 53.59167073159099,
"volume_molar": 16.136829235460656,
"formula_full": "Pb1 S1",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.3972604099999999,
"spacegroup": 225
},
{
"id": "jvasp-102127",
"created_at": "2022-09-04T14:36:41.954016Z",
"updated_at": "2022-09-04T14:36:41.954041Z",
"structure_string": "Sm1 Zr1\n1.0\n3.373512 -0.000000 0.000000\n-1.686756 2.921547 -0.000000\n-0.000000 0.000000 5.514109\nSm Zr\n1 1\ndirect\n0.333332 0.666668 0.500000 Sm\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"Zr"
],
"chemical_system": "Sm-Zr",
"density": 7.38153667347516,
"density_atomic": 0.03680099086705366,
"volume": 54.34636277118597,
"volume_molar": 16.36407232010528,
"formula_full": "Sm1 Zr1",
"formula_reduced": "SmZr",
"formula_anonymous": "AB",
"energy_above_hull": 2.0262216875,
"spacegroup": 187
},
{
"id": "jvasp-14730",
"created_at": "2022-09-04T14:36:49.620038Z",
"updated_at": "2022-09-04T14:36:49.620055Z",
"structure_string": "Pr1 Zn1\n1.0\n3.703667 -0.000000 0.000000\n-0.000000 3.703667 0.000000\n-0.000000 -0.000000 3.703667\nPr Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Zn"
],
"chemical_system": "Pr-Zn",
"density": 6.743534427791945,
"density_atomic": 0.039367170374376745,
"volume": 50.803752999777636,
"volume_molar": 15.297367585046658,
"formula_full": "Pr1 Zn1",
"formula_reduced": "PrZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.5799919400000002,
"spacegroup": 221
},
{
"id": "jvasp-103615",
"created_at": "2022-09-04T14:36:41.861054Z",
"updated_at": "2022-09-04T14:36:41.861081Z",
"structure_string": "Mg2 Pb2\n1.0\n5.783306 -0.040595 1.596405\n4.743670 3.308454 1.596405\n-0.058293 -0.018096 5.418349\nMg Pb\n2 2\ndirect\n0.130043 0.130041 0.685936 Mg\n0.869960 0.869958 0.314062 Mg\n0.382176 0.382173 0.799668 Pb\n0.617826 0.617825 0.200331 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Pb"
],
"chemical_system": "Mg-Pb",
"density": 7.31825223853895,
"density_atomic": 0.03807394666456175,
"volume": 105.0587173229167,
"volume_molar": 15.81695959459137,
"formula_full": "Mg2 Pb2",
"formula_reduced": "MgPb",
"formula_anonymous": "AB",
"energy_above_hull": 0.213490328,
"spacegroup": 12
},
{
"id": "jvasp-101690",
"created_at": "2022-09-04T14:36:49.631393Z",
"updated_at": "2022-09-04T14:36:49.631406Z",
"structure_string": "Ta1 Ti1\n1.0\n2.831912 -0.015517 0.000000\n-0.929993 2.674898 0.000000\n-0.000000 -0.000000 4.626365\nTa Ti\n1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500001 Ti\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ta",
"Ti"
],
"chemical_system": "Ta-Ti",
"density": 10.862620769926151,
"density_atomic": 0.057178301797156994,
"volume": 34.978303607111386,
"volume_molar": 10.532213393402026,
"formula_full": "Ta1 Ti1",
"formula_reduced": "TaTi",
"formula_anonymous": "AB",
"energy_above_hull": 3.532863766666666,
"spacegroup": 65
},
{
"id": "jvasp-100789",
"created_at": "2022-09-04T14:36:49.638282Z",
"updated_at": "2022-09-04T14:36:49.638302Z",
"structure_string": "U1 Nb1\n1.0\n2.972311 -0.023518 0.000000\n-1.189522 2.724008 0.000000\n-0.000000 -0.000000 4.907909\nU Nb\n1 1\ndirect\n0.500000 0.500000 0.500000 U\n0.000000 0.000000 0.000000 Nb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"Nb"
],
"chemical_system": "Nb-U",
"density": 13.877019941031895,
"density_atomic": 0.050504959711670974,
"volume": 39.600071189401,
"volume_molar": 11.923860140429673,
"formula_full": "U1 Nb1",
"formula_reduced": "UNb",
"formula_anonymous": "AB",
"energy_above_hull": 3.9092227,
"spacegroup": 65
},
{
"id": "jvasp-7648",
"created_at": "2022-09-04T14:37:03.635352Z",
"updated_at": "2022-09-04T14:37:03.635369Z",
"structure_string": "Zn4 S4\n1.0\n1.919381 -3.324466 0.000000\n1.919381 3.324466 0.000000\n-0.000000 0.000000 12.578648\nZn S\n4 4\ndirect\n0.333333 0.666667 0.249908 Zn\n0.666667 0.333333 0.749908 Zn\n0.000000 0.000000 0.499784 Zn\n0.000000 0.000000 0.999784 Zn\n0.333333 0.666667 0.062472 S\n0.666667 0.333333 0.562472 S\n0.000000 0.000000 0.312836 S\n0.000000 0.000000 0.812836 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zn",
"S"
],
"chemical_system": "S-Zn",
"density": 4.033209954415862,
"density_atomic": 0.04983597281022449,
"volume": 160.52661458950587,
"volume_molar": 12.083923359803425,
"formula_full": "Zn4 S4",
"formula_reduced": "ZnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.000935,
"spacegroup": 186
},
{
"id": "jvasp-7711",
"created_at": "2022-09-04T14:36:49.699290Z",
"updated_at": "2022-09-04T14:36:49.699323Z",
"structure_string": "Zr1 Ir1\n1.0\n3.307878 0.000000 -0.000000\n0.000000 3.307878 0.000000\n0.000000 0.000000 3.307878\nZr Ir\n1 1\ndirect\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Ir"
],
"chemical_system": "Ir-Zr",
"density": 13.003591501195809,
"density_atomic": 0.055256267394486275,
"volume": 36.194989171483,
"volume_molar": 10.89856597986732,
"formula_full": "Zr1 Ir1",
"formula_reduced": "ZrIr",
"formula_anonymous": "AB",
"energy_above_hull": 2.5421428000000006,
"spacegroup": 221
},
{
"id": "jvasp-11989",
"created_at": "2022-09-04T14:36:56.055000Z",
"updated_at": "2022-09-04T14:36:56.055023Z",
"structure_string": "Mg3 Ni3\n1.0\n-4.309510 2.441414 -0.016600\n-0.040429 -4.952852 0.016600\n-1.403742 2.431352 4.080805\nMg Ni\n3 3\ndirect\n0.500054 0.833389 0.000002 Mg\n0.880290 0.453126 0.380231 Mg\n0.119791 0.213623 0.619771 Mg\n0.499921 0.333308 -0.000026 Ni\n0.499969 0.833303 0.500001 Ni\n0.999972 0.833254 0.000027 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni",
"density": 4.712453093819972,
"density_atomic": 0.0683845854033055,
"volume": 87.73907108764863,
"volume_molar": 8.806283937357772,
"formula_full": "Mg3 Ni3",
"formula_reduced": "MgNi",
"formula_anonymous": "AB",
"energy_above_hull": 0.3782274571428571,
"spacegroup": 166
},
{
"id": "jvasp-7761",
"created_at": "2022-09-04T14:37:03.646899Z",
"updated_at": "2022-09-04T14:37:03.646925Z",
"structure_string": "Mg1 S1\n1.0\n3.471656 0.000000 2.004362\n1.157218 3.273109 2.004362\n-0.000000 -0.000000 4.008722\nMg S\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.249999 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"S"
],
"chemical_system": "Mg-S",
"density": 2.0549158374309213,
"density_atomic": 0.043906306287879435,
"volume": 45.55154302633994,
"volume_molar": 13.715890196990776,
"formula_full": "Mg1 S1",
"formula_reduced": "MgS",
"formula_anonymous": "AB",
"energy_above_hull": 0.012415,
"spacegroup": 216
},
{
"id": "jvasp-107337",
"created_at": "2022-09-04T14:36:50.329647Z",
"updated_at": "2022-09-04T14:36:50.329666Z",
"structure_string": "Hf1 Ti1\n1.0\n3.080936 -0.000000 0.000000\n-1.540467 2.668169 0.000000\n-0.000000 -0.000000 4.800532\nHf Ti\n1 1\ndirect\n0.666667 0.333333 0.500000 Hf\n0.333333 0.666667 -0.000000 Ti\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"Ti"
],
"chemical_system": "Hf-Ti",
"density": 9.524839077561557,
"density_atomic": 0.05068093468392549,
"volume": 39.46257132929992,
"volume_molar": 11.882457964829223,
"formula_full": "Hf1 Ti1",
"formula_reduced": "HfTi",
"formula_anonymous": "AB",
"energy_above_hull": 3.122845666666666,
"spacegroup": 187
},
{
"id": "jvasp-79269",
"created_at": "2022-09-04T14:36:41.901669Z",
"updated_at": "2022-09-04T14:36:41.901701Z",
"structure_string": "Tl2 Br2\n1.0\n4.093113 -0.000000 -1.437501\n-0.000000 5.041170 -0.000000\n0.004376 0.000000 6.558536\nTl Br\n2 2\ndirect\n0.612134 0.250000 0.224268 Tl\n0.387867 0.750000 0.775733 Tl\n0.132900 0.750000 0.265801 Br\n0.867100 0.250000 0.734200 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"Br"
],
"chemical_system": "Br-Tl",
"density": 6.974977516150377,
"density_atomic": 0.029550596466749332,
"volume": 135.3610579231741,
"volume_molar": 20.379083605896692,
"formula_full": "Tl2 Br2",
"formula_reduced": "TlBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0011499999999999,
"spacegroup": 63
}
]
}