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=12138",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=12136",
"results": [
{
"id": "mp-11343",
"created_at": "2022-09-04T14:44:53.811303Z",
"structure_string": "Th1\n1.0\n-2.005547 2.005547 2.005547\n2.005547 -2.005547 2.005547\n2.005547 2.005547 -2.005547\nTh\n1\ndirect\n0.000000 0.000000 0.000000 Th\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Th"
],
"chemical_system": "Th",
"density": 11.941250241983797,
"density_atomic": 0.03099142004223863,
"volume": 32.26699514372321,
"volume_molar": 19.43163866577376,
"formula_full": "Th1",
"formula_reduced": "Th",
"formula_anonymous": "A",
"energy": -7.25530224,
"energy_per_atom": -7.25530224,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.25530224,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005351,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:42.112000Z",
"spacegroup": 229
},
{
"id": "mp-19",
"created_at": "2022-09-04T14:39:15.342777Z",
"structure_string": "Te3\n1.0\n2.256187 -3.907831 0.000000\n2.256187 3.907831 0.000000\n0.000000 0.000000 5.959899\nTe\n3\ndirect\n0.268950 0.000000 0.333333 Te\n0.000000 0.268950 0.666667 Te\n0.731050 0.731050 0.000000 Te\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.0484105835889945,
"density_atomic": 0.028545752289368467,
"volume": 105.09444521163715,
"volume_molar": 21.09645140528623,
"formula_full": "Te3",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -9.42990279,
"energy_per_atom": -3.14330093,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.42990279,
"band_gap": 0.5129000000000001,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:43.257000Z",
"spacegroup": 152
},
{
"id": "mp-567313",
"created_at": "2022-09-04T14:43:00.719219Z",
"structure_string": "Te3\n1.0\n2.253370 -3.902951 0.000000\n2.253370 3.902951 0.000000\n0.000000 0.000000 5.962127\nTe\n3\ndirect\n0.000000 0.269108 0.333333 Te\n0.269108 0.000000 0.666667 Te\n0.730892 0.730892 0.000000 Te\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.0612779692512415,
"density_atomic": 0.02860648050856755,
"volume": 104.87134197097436,
"volume_molar": 21.051666101310115,
"formula_full": "Te3",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -9.42984729,
"energy_per_atom": -3.1432824299999997,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.42984729,
"band_gap": 0.5124000000000004,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 5.31e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:04.070000Z",
"spacegroup": 154
},
{
"id": "mp-1064307",
"created_at": "2022-09-04T14:42:21.845053Z",
"structure_string": "Te4\n1.0\n3.107127 0.000000 0.000000\n0.000000 5.247562 0.000000\n0.000000 0.000000 8.299455\nTe\n4\ndirect\n0.237769 0.795716 0.109852 Te\n0.762231 0.704284 0.609852 Te\n0.237769 0.204284 0.890148 Te\n0.762231 0.295716 0.390148 Te\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.263161426196037,
"density_atomic": 0.029559278780712617,
"volume": 135.32129892864617,
"volume_molar": 20.37309774935861,
"formula_full": "Te4",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -12.08209739,
"energy_per_atom": -3.0205243475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.08209739,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0114013,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:43.531000Z",
"spacegroup": 18
},
{
"id": "mp-1178952",
"created_at": "2022-09-04T14:45:24.865588Z",
"structure_string": "Te4\n1.0\n3.130769 0.000000 0.000000\n0.000000 4.742908 0.000000\n0.000000 0.000000 8.985613\nTe\n4\ndirect\n0.500000 0.545271 0.760814 Te\n0.500000 0.454729 0.260814 Te\n0.500000 0.987468 0.009186 Te\n0.500000 0.012532 0.509186 Te\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.352085390179579,
"density_atomic": 0.02997895952384046,
"volume": 133.42691219216735,
"volume_molar": 20.087891159834797,
"formula_full": "Te4",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -12.37668086,
"energy_per_atom": -3.094170215,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.37668086,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.4e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:05.527000Z",
"spacegroup": 26
},
{
"id": "mp-105",
"created_at": "2022-09-04T14:45:22.109555Z",
"structure_string": "Te4\n1.0\n3.196941 0.000000 0.000000\n0.000000 4.428183 0.000000\n0.000000 0.000000 9.268765\nTe\n4\ndirect\n0.500000 0.525868 0.750000 Te\n0.500000 0.474132 0.250000 Te\n0.500000 0.000000 0.000000 Te\n0.500000 0.000000 0.500000 Te\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.459184802981083,
"density_atomic": 0.030484420134676577,
"volume": 131.21456738650338,
"volume_molar": 19.754814864100716,
"formula_full": "Te4",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -12.38496355,
"energy_per_atom": -3.0962408875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.38496355,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0100078,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:04.670000Z",
"spacegroup": 51
},
{
"id": "mp-570459",
"created_at": "2022-09-04T14:47:09.689888Z",
"structure_string": "Te3\n1.0\n2.156428 3.810300 0.000000\n-2.156428 3.810300 0.000000\n0.000000 0.082601 6.003994\nTe\n3\ndirect\n0.313229 0.313229 0.662325 Te\n0.686771 0.686771 0.337675 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.4425329489238905,
"density_atomic": 0.03040583094260601,
"volume": 98.66528580201589,
"volume_molar": 19.805874640845637,
"formula_full": "Te3",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -9.29897096,
"energy_per_atom": -3.0996569866666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.29897096,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012314,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:55.743000Z",
"spacegroup": 12
},
{
"id": "mp-10654",
"created_at": "2022-09-04T14:40:09.085617Z",
"structure_string": "Te1\n1.0\n3.197462 0.000000 0.000000\n0.000000 3.197462 0.000000\n0.000000 0.000000 3.197462\nTe\n1\ndirect\n0.500000 0.500000 0.500000 Te\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.481620453792556,
"density_atomic": 0.030590306221883155,
"volume": 32.69009446151401,
"volume_molar": 19.686435030493374,
"formula_full": "Te1",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -3.09675431,
"energy_per_atom": -3.09675431,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.09675431,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001527,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:47.250000Z",
"spacegroup": 221
},
{
"id": "mp-9924",
"created_at": "2022-09-04T14:47:03.395430Z",
"structure_string": "Te1\n1.0\n1.507200 -4.327025 0.000000\n1.507200 4.327025 0.000000\n0.000000 0.000000 2.989988\nTe\n1\ndirect\n0.500000 0.500000 0.000000 Te\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 5.433004202924278,
"density_atomic": 0.025641313535257337,
"volume": 38.99956211779008,
"volume_molar": 23.486085265169557,
"formula_full": "Te1",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -3.01589919,
"energy_per_atom": -3.01589919,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.01589919,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001566,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:49.897000Z",
"spacegroup": 65
},
{
"id": "mp-1178932",
"created_at": "2022-09-04T14:47:08.133102Z",
"structure_string": "Te1\n1.0\n2.157882 -2.358491 0.000000\n2.157882 2.358491 0.000000\n-0.419868 0.000000 3.169014\nTe\n1\ndirect\n0.000000 0.000000 0.000000 Te\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.568764661121117,
"density_atomic": 0.031001587321516835,
"volume": 32.256412861348686,
"volume_molar": 19.425265866371614,
"formula_full": "Te1",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -3.08921044,
"energy_per_atom": -3.08921044,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.08921044,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001557,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:50.979000Z",
"spacegroup": 166
},
{
"id": "mp-113",
"created_at": "2022-09-04T14:40:26.996512Z",
"structure_string": "Tc2\n1.0\n1.380358 -2.390851 0.000000\n1.380358 2.390851 0.000000\n0.000000 0.000000 4.421340\nTc\n2\ndirect\n0.333333 0.666667 0.250000 Tc\n0.666667 0.333333 0.750000 Tc\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.152622748727236,
"density_atomic": 0.06853333067267706,
"volume": 29.182880510393204,
"volume_molar": 8.787170710792426,
"formula_full": "Tc2",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"energy": -20.72123982,
"energy_per_atom": -10.36061991,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.72123982,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0035913,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:00.179000Z",
"spacegroup": 194
},
{
"id": "mp-8638",
"created_at": "2022-09-04T14:40:30.936168Z",
"structure_string": "Tc1\n1.0\n0.000000 1.942519 1.942519\n1.942519 0.000000 1.942519\n1.942519 1.942519 0.000000\nTc\n1\ndirect\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.100674069024633,
"density_atomic": 0.06821410387515324,
"volume": 14.659724942369971,
"volume_molar": 8.828292710583487,
"formula_full": "Tc1",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"energy": -10.29376611,
"energy_per_atom": -10.29376611,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.29376611,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.19e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:58Z",
"spacegroup": 225
}
]
}