HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=10416",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=10414",
"results": [
{
"id": "mp-1094898",
"created_at": "2022-09-04T14:48:10.837254Z",
"structure_string": "Zr2 Sn2\n1.0\n3.166376 0.000000 0.000000\n0.000000 5.302816 0.000000\n0.000000 0.000000 5.472154\nZr Sn\n2 2\ndirect\n0.000000 0.189802 0.250000 Zr\n0.000000 0.810198 0.750000 Zr\n0.500000 0.692529 0.250000 Sn\n0.500000 0.307471 0.750000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.588125756945772,
"density_atomic": 0.0435344074125209,
"volume": 91.88134713990762,
"volume_molar": 13.833060142373677,
"formula_full": "Zr2 Sn2",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy": -26.46137192,
"energy_per_atom": -6.61534298,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.46137192,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0011744,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:31.208000Z",
"spacegroup": 51
},
{
"id": "mp-1094291",
"created_at": "2022-09-04T14:45:18.908572Z",
"structure_string": "Zr12 Sn12\n1.0\n5.350371 0.000000 0.000000\n0.000000 6.719731 0.000000\n0.000000 0.000000 15.691529\nZr Sn\n12 12\ndirect\n0.250000 0.877050 0.848039 Zr\n0.250000 0.371692 0.840984 Zr\n0.750000 0.624675 0.826665 Zr\n0.250000 0.624675 0.673335 Zr\n0.750000 0.877050 0.651961 Zr\n0.750000 0.371692 0.659016 Zr\n0.250000 0.628308 0.340984 Zr\n0.250000 0.122950 0.348039 Zr\n0.750000 0.375325 0.326665 Zr\n0.250000 0.375325 0.173335 Zr\n0.750000 0.628308 0.159016 Zr\n0.750000 0.122950 0.151961 Zr\n0.750000 0.869650 0.989552 Sn\n0.750000 0.376702 0.989962 Sn\n0.750000 0.115650 0.814696 Sn\n0.250000 0.115650 0.685304 Sn\n0.250000 0.869650 0.510448 Sn\n0.250000 0.376702 0.510038 Sn\n0.750000 0.623298 0.489962 Sn\n0.750000 0.130350 0.489552 Sn\n0.750000 0.884350 0.314696 Sn\n0.250000 0.884350 0.185304 Sn\n0.250000 0.623298 0.010038 Sn\n0.250000 0.130350 0.010448 Sn\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.415015701269237,
"density_atomic": 0.042541244682695524,
"volume": 564.1583874428212,
"volume_molar": 14.156005083813689,
"formula_full": "Zr12 Sn12",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy": -156.36335363,
"energy_per_atom": -6.515139734583333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -156.36335363,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.043213,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:58.310000Z",
"spacegroup": 57
},
{
"id": "mp-1094312",
"created_at": "2022-09-04T14:44:41.396708Z",
"structure_string": "Zr1 Sn3\n1.0\n-2.182088 2.182088 5.120522\n2.182088 -2.182088 5.120522\n2.182088 2.182088 -5.120522\nZr Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.000000 Sn\n0.250000 0.750000 0.500000 Sn\n0.750000 0.250000 0.500000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.6169599608552305,
"density_atomic": 0.04101486077102798,
"volume": 97.52562668274409,
"volume_molar": 14.68282628976742,
"formula_full": "Zr1 Sn3",
"formula_reduced": "ZrSn3",
"formula_anonymous": "AB3",
"energy": -21.10675844,
"energy_per_atom": -5.27668961,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.10675844,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.33e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:41.691000Z",
"spacegroup": 139
},
{
"id": "mp-1094261",
"created_at": "2022-09-04T14:45:58.381967Z",
"structure_string": "Zr4 Sn4\n1.0\n3.136689 0.000000 0.000000\n0.000000 5.114582 0.000000\n0.000000 0.000000 12.426056\nZr Sn\n4 4\ndirect\n0.000000 0.000000 0.537177 Zr\n0.500000 0.000000 0.293685 Zr\n0.000000 0.500000 0.706315 Zr\n0.500000 0.500000 0.462823 Zr\n0.000000 0.000000 0.066684 Sn\n0.500000 0.000000 0.759064 Sn\n0.000000 0.500000 0.240936 Sn\n0.500000 0.500000 0.933316 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 6.994826653746834,
"density_atomic": 0.040130546471958156,
"volume": 199.34939100792272,
"volume_molar": 15.00637616337486,
"formula_full": "Zr4 Sn4",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy": -51.21051285,
"energy_per_atom": -6.40131410625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.21051285,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0126854,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:14.616000Z",
"spacegroup": 59
},
{
"id": "mp-1094269",
"created_at": "2022-09-04T14:48:10.300643Z",
"structure_string": "Zr6 Sn6\n1.0\n5.319826 0.000000 0.000000\n0.000000 5.481775 0.000000\n0.000000 0.000000 9.601624\nZr Sn\n6 6\ndirect\n0.000000 0.947502 0.920148 Zr\n0.000000 0.008994 0.588910 Zr\n0.500000 0.374212 0.904997 Zr\n0.000000 0.508994 0.411090 Zr\n0.000000 0.447502 0.079852 Zr\n0.500000 0.874212 0.095003 Zr\n0.000000 0.982925 0.247661 Sn\n0.500000 0.318056 0.562012 Sn\n0.500000 0.368371 0.224038 Sn\n0.000000 0.482925 0.752339 Sn\n0.500000 0.868371 0.775962 Sn\n0.500000 0.818056 0.437988 Sn\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.469986208507498,
"density_atomic": 0.042856620117214764,
"volume": 280.0034152758539,
"volume_molar": 14.051833167266054,
"formula_full": "Zr6 Sn6",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy": -78.7940521,
"energy_per_atom": -6.566171008333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -78.7940521,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008225,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:31.771000Z",
"spacegroup": 26
},
{
"id": "mp-1094272",
"created_at": "2022-09-04T14:41:04.063686Z",
"structure_string": "Zr4 Sn2\n1.0\n2.644042 -4.879742 0.000000\n2.644042 4.879742 0.000000\n0.000000 0.000000 5.270753\nZr Sn\n4 2\ndirect\n0.905630 0.579138 0.750000 Zr\n0.579138 0.905630 0.750000 Zr\n0.420862 0.094370 0.250000 Zr\n0.094370 0.420862 0.250000 Zr\n0.239452 0.239452 0.750000 Sn\n0.760548 0.760548 0.250000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.353695231277735,
"density_atomic": 0.044114705042734265,
"volume": 136.0090698597611,
"volume_molar": 13.651096055535914,
"formula_full": "Zr4 Sn2",
"formula_reduced": "Zr2Sn",
"formula_anonymous": "AB2",
"energy": -44.71382058,
"energy_per_atom": -7.45230343,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.71382058,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004424,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:23.563000Z",
"spacegroup": 63
},
{
"id": "mp-543001",
"created_at": "2022-09-04T14:41:18.366099Z",
"structure_string": "Zr10 Sn8\n1.0\n4.429499 -7.672117 0.000000\n4.429499 7.672117 0.000000\n0.000000 0.000000 5.979332\nZr Sn\n10 8\ndirect\n0.333333 0.666667 0.000000 Zr\n0.666667 0.333333 0.500000 Zr\n0.666667 0.333333 0.000000 Zr\n0.333333 0.666667 0.500000 Zr\n0.280836 0.000000 0.250000 Zr\n0.280836 0.280836 0.750000 Zr\n0.000000 0.719164 0.750000 Zr\n0.000000 0.280836 0.250000 Zr\n0.719164 0.719164 0.250000 Zr\n0.719164 0.000000 0.750000 Zr\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n0.613897 0.000000 0.250000 Sn\n0.613897 0.613897 0.750000 Sn\n0.000000 0.386103 0.750000 Sn\n0.000000 0.613897 0.250000 Sn\n0.386103 0.386103 0.250000 Sn\n0.386103 0.000000 0.750000 Sn\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.607774397621459,
"density_atomic": 0.0442914620153068,
"volume": 406.3988674336226,
"volume_molar": 13.596617691054751,
"formula_full": "Zr10 Sn8",
"formula_reduced": "Zr5Sn4",
"formula_anonymous": "A4B5",
"energy": -128.2219862,
"energy_per_atom": -7.123443677777778,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -128.2219862,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012212,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:18.014000Z",
"spacegroup": 193
},
{
"id": "mp-1094267",
"created_at": "2022-09-04T14:41:20.765578Z",
"structure_string": "Zr6 Sn2\n1.0\n5.148362 0.000000 0.000000\n0.000000 5.725013 0.000000\n0.000000 0.000000 6.128148\nZr Sn\n6 2\ndirect\n0.000000 0.648441 0.249997 Zr\n0.000000 0.134153 0.500000 Zr\n0.000000 0.648441 0.750003 Zr\n0.500000 0.865847 0.000000 Zr\n0.500000 0.351559 0.250003 Zr\n0.500000 0.351559 0.749997 Zr\n0.000000 0.166693 0.000000 Sn\n0.500000 0.833307 0.500000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.214618498106379,
"density_atomic": 0.044290969657436806,
"volume": 180.6237267297384,
"volume_molar": 13.59676883702824,
"formula_full": "Zr6 Sn2",
"formula_reduced": "Zr3Sn",
"formula_anonymous": "AB3",
"energy": -62.06556665,
"energy_per_atom": -7.75819583125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -62.06556665,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004981,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:18.771000Z",
"spacegroup": 59
},
{
"id": "mp-1094315",
"created_at": "2022-09-04T14:46:08.602633Z",
"structure_string": "Zr8 Sn6\n1.0\n4.187319 -7.252649 0.000000\n4.187319 7.252649 0.000000\n0.000000 0.000000 5.303637\nZr Sn\n8 6\ndirect\n0.023482 0.787342 0.750000 Zr\n0.666667 0.333333 0.250000 Zr\n0.333333 0.666667 0.750000 Zr\n0.976518 0.212658 0.250000 Zr\n0.763860 0.976518 0.750000 Zr\n0.212658 0.236140 0.750000 Zr\n0.787342 0.763860 0.250000 Zr\n0.236140 0.023482 0.250000 Zr\n0.451813 0.074849 0.750000 Sn\n0.074849 0.623036 0.250000 Sn\n0.925151 0.376964 0.750000 Sn\n0.548187 0.925151 0.250000 Sn\n0.376964 0.451813 0.250000 Sn\n0.623036 0.548187 0.750000 Sn\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.433503045889425,
"density_atomic": 0.04346018200230425,
"volume": 322.1339477882933,
"volume_molar": 13.856685551111378,
"formula_full": "Zr8 Sn6",
"formula_reduced": "Zr4Sn3",
"formula_anonymous": "A3B4",
"energy": -97.09409708,
"energy_per_atom": -6.935292648571428,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -97.09409708,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0860357,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:27.852000Z",
"spacegroup": 176
},
{
"id": "mp-1094278",
"created_at": "2022-09-04T14:42:08.239293Z",
"structure_string": "Zr6 Sn6\n1.0\n5.226968 0.000000 0.000000\n0.000000 5.611233 0.000000\n0.000000 0.000000 9.545732\nZr Sn\n6 6\ndirect\n0.000000 0.955932 0.263814 Zr\n0.000000 0.025278 0.937832 Zr\n0.500000 0.334471 0.238172 Zr\n0.000000 0.525278 0.062168 Zr\n0.000000 0.455932 0.736186 Zr\n0.500000 0.834471 0.761828 Zr\n0.000000 0.945950 0.607076 Sn\n0.500000 0.405046 0.568742 Sn\n0.500000 0.333384 0.911448 Sn\n0.000000 0.445950 0.392924 Sn\n0.500000 0.905046 0.431258 Sn\n0.500000 0.833384 0.088552 Sn\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.470776558200372,
"density_atomic": 0.04286115449192467,
"volume": 279.9737931058502,
"volume_molar": 14.050346593287893,
"formula_full": "Zr6 Sn6",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy": -78.74428707,
"energy_per_atom": -6.5620239225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -78.74428707,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020521,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:33.705000Z",
"spacegroup": 26
},
{
"id": "mp-1094528",
"created_at": "2022-09-04T14:47:22.080924Z",
"structure_string": "Zr4 Sn4\n1.0\n5.566301 0.000000 0.000000\n0.000000 5.581363 0.000000\n0.000000 0.000000 6.045072\nZr Sn\n4 4\ndirect\n0.250000 0.504492 0.871649 Zr\n0.250000 0.004492 0.128351 Zr\n0.750000 0.995508 0.871649 Zr\n0.750000 0.495508 0.128351 Zr\n0.250000 0.005532 0.642544 Sn\n0.250000 0.505532 0.357456 Sn\n0.750000 0.494468 0.642544 Sn\n0.750000 0.994468 0.357456 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.424777358518365,
"density_atomic": 0.042597249021226156,
"volume": 187.8055551430941,
"volume_molar": 14.137393607270681,
"formula_full": "Zr4 Sn4",
"formula_reduced": "ZrSn",
"formula_anonymous": "AB",
"energy": -53.2425398,
"energy_per_atom": -6.655317475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -53.2425398,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024291,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:06.574000Z",
"spacegroup": 57
},
{
"id": "mp-1094254",
"created_at": "2022-09-04T14:46:34.999205Z",
"structure_string": "Zr5 Sn1\n1.0\n2.783251 -4.820732 0.000000\n2.783251 4.820732 0.000000\n0.000000 0.000000 5.147051\nZr Sn\n5 1\ndirect\n0.666667 0.333333 0.000000 Zr\n0.333333 0.666667 0.000000 Zr\n0.000000 0.323061 0.500000 Zr\n0.676939 0.676939 0.500000 Zr\n0.323061 0.000000 0.500000 Zr\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 6.91090135192615,
"density_atomic": 0.04344076064313555,
"volume": 138.1191284676115,
"volume_molar": 13.86288055467466,
"formula_full": "Zr5 Sn1",
"formula_reduced": "Zr5Sn",
"formula_anonymous": "AB5",
"energy": -47.85636321,
"energy_per_atom": -7.976060534999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -47.85636321,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.04e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:40.084000Z",
"spacegroup": 189
}
]
}