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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=908",
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{
"id": "jvasp-74854",
"created_at": "2022-09-04T14:35:55.515412Z",
"updated_at": "2022-09-04T14:35:55.515427Z",
"structure_string": "Sr2 Zr1 Be1\n1.0\n-2.699507 2.699507 3.819082\n2.699507 -2.699507 3.819082\n2.699507 2.699507 -3.819082\nSr Zr Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.750000 0.500001 Sr\n0.500000 0.500000 0.000000 Zr\n0.750000 0.250000 0.500001 Be\n",
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{
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"created_at": "2022-09-04T14:36:57.190618Z",
"updated_at": "2022-09-04T14:36:57.190646Z",
"structure_string": "Sr2 Zn5 Si3\n1.0\n4.281824 0.000000 0.000000\n0.000000 4.281824 0.000000\n-0.000000 -0.000000 10.659929\nSr Zn Si\n2 5 3\ndirect\n0.000000 0.000000 0.995942 Sr\n0.500000 0.500000 0.503521 Sr\n-0.000000 0.500000 0.252463 Zn\n0.500000 0.000000 0.748232 Zn\n0.500000 0.000000 0.252463 Zn\n-0.000000 0.500000 0.748232 Zn\n0.500000 0.500000 0.115280 Zn\n0.000000 0.000000 0.614606 Si\n0.000000 0.000000 0.387562 Si\n0.500000 0.500000 0.881700 Si\n",
"nsites": 10,
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"elements": [
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"density": 4.983516570663403,
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"volume": 195.43931702077373,
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"formula_full": "Sr2 Zn5 Si3",
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"formula_anonymous": "A2B3C5",
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"spacegroup": 99
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{
"id": "jvasp-56213",
"created_at": "2022-09-04T14:37:29.751803Z",
"updated_at": "2022-09-04T14:37:29.751827Z",
"structure_string": "Sr2 Zn4\n1.0\n4.350909 0.000000 1.883170\n2.164397 5.505061 0.967131\n-0.011249 0.010210 5.993783\nSr Zn\n2 4\ndirect\n0.953411 0.796590 0.296589 Sr\n0.046590 0.203410 0.703410 Sr\n0.334971 0.224866 0.105193 Zn\n0.665030 0.775134 0.894806 Zn\n0.334971 0.605193 0.724866 Zn\n0.665030 0.394807 0.275134 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
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],
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"density": 5.049118542646312,
"density_atomic": 0.04175990796690592,
"volume": 143.67847756644738,
"volume_molar": 14.420866934794141,
"formula_full": "Sr2 Zn4",
"formula_reduced": "SrZn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1701861904761905,
"spacegroup": 74
},
{
"id": "jvasp-99613",
"created_at": "2022-09-04T14:36:21.069891Z",
"updated_at": "2022-09-04T14:36:21.069901Z",
"structure_string": "Sr2 Zn3 Cd1\n1.0\n4.677153 0.043537 3.883742\n2.149693 4.154091 3.883742\n0.006207 0.003816 7.834907\nSr Zn Cd\n2 3 1\ndirect\n0.452803 0.452805 0.795465 Sr\n0.546390 0.546391 0.203109 Sr\n0.175845 0.175845 0.389169 Zn\n0.153380 0.153380 0.788869 Zn\n0.835394 0.835396 0.217643 Zn\n0.836185 0.836187 0.605745 Cd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Zn",
"Cd"
],
"chemical_system": "Cd-Sr-Zn",
"density": 5.308627194084495,
"density_atomic": 0.03964135614703116,
"volume": 151.35708217816244,
"volume_molar": 15.191560898329696,
"formula_full": "Sr2 Zn3 Cd1",
"formula_reduced": "Sr2Zn3Cd",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0,
"spacegroup": 8
},
{
"id": "jvasp-35090",
"created_at": "2022-09-04T14:37:32.376032Z",
"updated_at": "2022-09-04T14:37:32.376051Z",
"structure_string": "Sr2 Zn2 Sn2\n1.0\n2.323967 -4.025229 0.000000\n2.323967 4.025229 -0.000000\n0.000000 0.000000 9.063060\nSr Zn Sn\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.666668 0.333334 0.750000 Zn\n0.333334 0.666668 0.250000 Zn\n0.666668 0.333334 0.250000 Sn\n0.333334 0.666668 0.750000 Sn\n",
"nsites": 6,
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"elements": [
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],
"chemical_system": "Sn-Sr-Zn",
"density": 5.322377388647227,
"density_atomic": 0.03538554181403997,
"volume": 169.56077800169143,
"volume_molar": 17.01864787502162,
"formula_full": "Sr2 Zn2 Sn2",
"formula_reduced": "SrZnSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-16163",
"created_at": "2022-09-04T14:36:42.978723Z",
"updated_at": "2022-09-04T14:36:42.978741Z",
"structure_string": "Sr2 Zn2 Si2\n1.0\n2.155184 -3.732889 -0.000000\n2.155184 3.732889 0.000000\n0.000000 0.000000 8.979067\nSr Zn Si\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.666666 0.333332 0.750000 Zn\n0.333332 0.666666 0.250000 Zn\n0.333332 0.666666 0.750000 Si\n0.666666 0.333332 0.250000 Si\n",
"nsites": 6,
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"elements": [
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],
"chemical_system": "Si-Sr-Zn",
"density": 4.1633380555723845,
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"volume": 144.4743130456065,
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"formula_full": "Sr2 Zn2 Si2",
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"formula_anonymous": "ABC",
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"spacegroup": 194
},
{
"id": "jvasp-91630",
"created_at": "2022-09-04T14:35:59.663499Z",
"updated_at": "2022-09-04T14:35:59.663525Z",
"structure_string": "Sr2 Zn2 Sb2 F2\n1.0\n4.325945 -0.000000 -0.000000\n-0.000000 4.325945 -0.000000\n-0.000000 -0.000000 9.432895\nSr Zn Sb F\n2 2 2 2\ndirect\n0.750001 0.750001 0.861035 Sr\n0.250000 0.250000 0.138965 Sr\n0.250000 0.750001 0.500000 Zn\n0.750001 0.250000 0.500000 Zn\n0.750001 0.750001 0.318697 Sb\n0.250000 0.250000 0.681302 Sb\n0.250000 0.750001 0.000000 F\n0.750001 0.250000 0.000000 F\n",
"nsites": 8,
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"elements": [
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"Zn",
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"F"
],
"chemical_system": "F-Sb-Sr-Zn",
"density": 5.527201230392381,
"density_atomic": 0.04531927981556276,
"volume": 176.52531180013983,
"volume_molar": 13.288253442041638,
"formula_full": "Sr2 Zn2 Sb2 F2",
"formula_reduced": "SrZnSbF",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-35091",
"created_at": "2022-09-04T14:37:33.920396Z",
"updated_at": "2022-09-04T14:37:33.920429Z",
"structure_string": "Sr2 Zn2 Pb2\n1.0\n2.378605 -4.119866 0.000000\n2.378605 4.119866 -0.000000\n0.000000 -0.000000 9.034696\nSr Zn Pb\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.333334 0.666668 0.250000 Zn\n0.666668 0.333334 0.750000 Zn\n0.333334 0.666668 0.750000 Pb\n0.666668 0.333334 0.250000 Pb\n",
"nsites": 6,
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"elements": [
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"Pb"
],
"chemical_system": "Pb-Sr-Zn",
"density": 6.75629817220038,
"density_atomic": 0.033884594485937086,
"volume": 177.071618858834,
"volume_molar": 17.772503556149484,
"formula_full": "Sr2 Zn2 Pb2",
"formula_reduced": "SrZnPb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-21539",
"created_at": "2022-09-04T14:36:37.720407Z",
"updated_at": "2022-09-04T14:36:37.720435Z",
"structure_string": "Sr2 Zn2 F8\n1.0\n5.057605 0.000001 -2.140619\n-0.906013 4.975792 -2.140618\n-0.002590 -0.003105 7.038950\nSr Zn F\n2 2 8\ndirect\n0.375000 0.124999 0.750000 Sr\n0.625000 0.874999 0.249999 Sr\n0.874999 0.624999 0.749999 Zn\n0.125000 0.375000 0.250000 Zn\n0.296006 0.453521 0.079865 F\n0.626343 0.796005 0.579864 F\n0.953521 0.283858 0.579864 F\n0.783858 0.126343 0.079864 F\n0.216142 0.873656 0.920135 F\n0.046478 0.716141 0.420135 F\n0.373657 0.203993 0.420135 F\n0.703993 0.546477 0.920134 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
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],
"chemical_system": "F-Sr-Zn",
"density": 4.295436306986522,
"density_atomic": 0.06776899911926969,
"volume": 177.0721149191043,
"volume_molar": 8.886276672614517,
"formula_full": "Sr2 Zn2 F8",
"formula_reduced": "SrZnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 88
},
{
"id": "jvasp-12478",
"created_at": "2022-09-04T14:38:06.590511Z",
"updated_at": "2022-09-04T14:38:06.590521Z",
"structure_string": "Sr2 Zn2 Cl8\n1.0\n6.020087 -0.000001 -2.482326\n-1.023564 5.932433 -2.482327\n-0.003062 -0.003635 8.533630\nSr Zn Cl\n2 2 8\ndirect\n0.875001 0.625000 0.750000 Sr\n0.125000 0.375000 0.250000 Sr\n0.625001 0.875000 0.250000 Zn\n0.375001 0.125001 0.750000 Zn\n0.716837 0.364858 0.914685 Cl\n0.864858 0.697849 0.414685 Cl\n0.283165 0.635143 0.085315 Cl\n0.450174 0.783165 0.585315 Cl\n0.549828 0.216836 0.414685 Cl\n0.802153 0.950173 0.085315 Cl\n0.135143 0.302152 0.585315 Cl\n0.197849 0.049828 0.914685 Cl\n",
"nsites": 12,
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"elements": [
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],
"chemical_system": "Cl-Sr-Zn",
"density": 3.2140484129593583,
"density_atomic": 0.039388250532967996,
"volume": 304.6593803387127,
"volume_molar": 15.289180602117538,
"formula_full": "Sr2 Zn2 Cl8",
"formula_reduced": "SrZnCl4",
"formula_anonymous": "ABC4",
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"spacegroup": 88
},
{
"id": "jvasp-91850",
"created_at": "2022-09-04T14:37:40.691744Z",
"updated_at": "2022-09-04T14:37:40.691766Z",
"structure_string": "Sr2 Zn2 Bi4\n1.0\n4.556130 -0.000000 -0.941884\n-0.194715 4.551967 -0.941884\n0.008959 0.009351 11.533854\nSr Zn Bi\n2 2 4\ndirect\n0.877312 0.877313 0.754626 Sr\n0.122687 0.122687 0.245374 Sr\n0.249999 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.330023 0.330023 0.660048 Bi\n0.669976 0.669977 0.339953 Bi\n0.500000 -0.000000 0.000000 Bi\n-0.000001 0.500000 0.000000 Bi\n",
"nsites": 8,
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"elements": [
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],
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"density": 7.9248691083645655,
"density_atomic": 0.03343294559142018,
"volume": 239.28492863796663,
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"formula_full": "Sr2 Zn2 Bi4",
"formula_reduced": "SrZnBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-90847",
"created_at": "2022-09-04T14:35:46.418582Z",
"updated_at": "2022-09-04T14:35:46.418603Z",
"structure_string": "Sr2 Zn2 As2 F2\n1.0\n4.128799 0.000000 0.000000\n-0.000000 4.128799 0.000000\n-0.000000 -0.000000 9.111187\nSr Zn As F\n2 2 2 2\ndirect\n0.750000 0.750000 0.846135 Sr\n0.250000 0.250000 0.153865 Sr\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.750000 0.750000 0.327560 As\n0.250000 0.250000 0.672441 As\n0.250000 0.750000 0.000000 F\n0.750000 0.250000 0.000000 F\n",
"nsites": 8,
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"elements": [
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],
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"density": 5.280364815613863,
"density_atomic": 0.05150715294689996,
"volume": 155.3182333383366,
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"formula_full": "Sr2 Zn2 As2 F2",
"formula_reduced": "SrZnAsF",
"formula_anonymous": "ABCD",
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"spacegroup": 129
}
]
}