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=energy_uncorrected&page=10181",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_uncorrected&page=10179",
"results": [
{
"id": "mp-1069765",
"created_at": "2022-09-04T14:41:10.410139Z",
"structure_string": "Sm1 Si3 Rh1\n1.0\n-2.102705 2.102705 4.921542\n2.102705 -2.102705 4.921542\n2.102705 2.102705 -4.921542\nSm Si Rh\n1 3 1\ndirect\n0.999042 0.999042 0.000000 Sm\n0.414461 0.414461 0.000000 Si\n0.263281 0.763281 0.500000 Si\n0.763281 0.263281 0.500000 Si\n0.653935 0.653935 0.000000 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Si",
"Rh"
],
"chemical_system": "Rh-Si-Sm",
"density": 6.4392205656824215,
"density_atomic": 0.057444985281888544,
"volume": 87.0397994788314,
"volume_molar": 10.483318483673946,
"formula_full": "Sm1 Si3 Rh1",
"formula_reduced": "SmSi3Rh",
"formula_anonymous": "ABC3",
"energy": -32.32920116,
"energy_per_atom": -6.465840232,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32920116,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.8e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:14.966000Z",
"spacegroup": 107
},
{
"id": "mp-1184846",
"created_at": "2022-09-04T14:48:15.496209Z",
"structure_string": "Ho1 Th1 Ru2\n1.0\n0.000000 3.473446 3.473446\n3.473446 0.000000 3.473446\n3.473446 3.473446 0.000000\nHo Th Ru\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.000000 0.000000 Th\n0.250000 0.250000 0.250000 Ru\n0.750000 0.750000 0.750000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Th",
"Ru"
],
"chemical_system": "Ho-Ru-Th",
"density": 11.869784701204749,
"density_atomic": 0.047725264190931205,
"volume": 83.81305096599304,
"volume_molar": 12.618349761056603,
"formula_full": "Ho1 Th1 Ru2",
"formula_reduced": "HoThRu2",
"formula_anonymous": "ABC2",
"energy": -32.32792527,
"energy_per_atom": -8.0819813175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32792527,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0018106,
"is_theoretical": true,
"updated_at": "2021-11-28T01:40:05.019000Z",
"spacegroup": 225
},
{
"id": "mp-5514",
"created_at": "2022-09-04T14:43:35.940379Z",
"structure_string": "Tb2 Cu2 Si2\n1.0\n2.078320 -3.599755 0.000000\n2.078320 3.599755 0.000000\n0.000000 0.000000 7.529170\nTb Cu Si\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.000000 0.000000 0.500000 Tb\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.750000 Cu\n0.666667 0.333333 0.250000 Si\n0.333333 0.666667 0.750000 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Cu",
"Si"
],
"chemical_system": "Cu-Si-Tb",
"density": 7.386231483909955,
"density_atomic": 0.053258482892111415,
"volume": 112.65810954762875,
"volume_molar": 11.307383224188673,
"formula_full": "Tb2 Cu2 Si2",
"formula_reduced": "TbCuSi",
"formula_anonymous": "ABC",
"energy": -32.18541817,
"energy_per_atom": -5.364236361666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32741817,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0063266,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:13.993000Z",
"spacegroup": 194
},
{
"id": "mp-862756",
"created_at": "2022-09-04T14:42:13.978216Z",
"structure_string": "Pr2 Ga6\n1.0\n3.258503 -5.643893 0.000000\n3.258503 5.643893 0.000000\n0.000000 0.000000 4.622851\nPr Ga\n2 6\ndirect\n0.333333 0.666667 0.750000 Pr\n0.666667 0.333333 0.250000 Pr\n0.142349 0.284698 0.250000 Ga\n0.715302 0.857651 0.250000 Ga\n0.142349 0.857651 0.250000 Ga\n0.857651 0.715302 0.750000 Ga\n0.284698 0.142349 0.750000 Ga\n0.857651 0.142349 0.750000 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pr",
"Ga"
],
"chemical_system": "Ga-Pr",
"density": 6.837627684045175,
"density_atomic": 0.04704930350770072,
"volume": 170.03439803716992,
"volume_molar": 12.799638487771311,
"formula_full": "Pr2 Ga6",
"formula_reduced": "PrGa3",
"formula_anonymous": "AB3",
"energy": -32.32671429,
"energy_per_atom": -4.04083928625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32671429,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0051783,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.416000Z",
"spacegroup": 194
},
{
"id": "mp-1228933",
"created_at": "2022-09-04T14:45:23.895836Z",
"structure_string": "Al1 Co4\n1.0\n10.002101 -1.289337 0.000000\n10.002101 1.289337 0.000000\n9.835897 0.000000 2.227003\nAl Co\n1 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.598855 0.598855 0.598855 Co\n0.200321 0.200321 0.200321 Co\n0.799679 0.799679 0.799679 Co\n0.401145 0.401145 0.401145 Co\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Al",
"Co"
],
"chemical_system": "Al-Co",
"density": 7.594940255047482,
"density_atomic": 0.08704854676217909,
"volume": 57.43921278387617,
"volume_molar": 6.918140490561876,
"formula_full": "Al1 Co4",
"formula_reduced": "AlCo4",
"formula_anonymous": "AB4",
"energy": -32.32619853,
"energy_per_atom": -6.465239706,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32619853,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.9617287,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:06.727000Z",
"spacegroup": 166
},
{
"id": "mp-1206542",
"created_at": "2022-09-04T14:47:12.233260Z",
"structure_string": "Dy3 Cd3 Au3\n1.0\n3.940824 -6.825708 0.000000\n3.940824 6.825708 0.000000\n0.000000 0.000000 3.848499\nDy Cd Au\n3 3 3\ndirect\n0.592918 0.000000 0.000000 Dy\n0.000000 0.592918 0.000000 Dy\n0.407082 0.407082 0.000000 Dy\n0.263292 0.000000 0.500000 Cd\n0.000000 0.263292 0.500000 Cd\n0.736708 0.736708 0.500000 Cd\n0.333333 0.666667 0.500000 Au\n0.666667 0.333333 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Dy",
"Cd",
"Au"
],
"chemical_system": "Au-Cd-Dy",
"density": 11.353860841114392,
"density_atomic": 0.04346967476532349,
"volume": 207.0408865165804,
"volume_molar": 13.853659574200371,
"formula_full": "Dy3 Cd3 Au3",
"formula_reduced": "DyCdAu",
"formula_anonymous": "ABC",
"energy": -32.32580837,
"energy_per_atom": -3.591756485555555,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32580837,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007116,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:56.994000Z",
"spacegroup": 189
},
{
"id": "mp-22857",
"created_at": "2022-09-04T14:39:42.972727Z",
"structure_string": "Cr2 Cl4\n1.0\n3.488991 0.000000 0.000000\n0.000000 6.165321 0.000000\n0.000000 0.000000 6.929747\nCr Cl\n2 4\ndirect\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.500000 0.786348 0.136831 Cl\n0.500000 0.213652 0.863169 Cl\n0.000000 0.713652 0.636831 Cl\n0.000000 0.286348 0.363169 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr",
"density": 2.738201948906607,
"density_atomic": 0.04025115332769851,
"volume": 149.0640516844805,
"volume_molar": 14.961411691664278,
"formula_full": "Cr2 Cl4",
"formula_reduced": "CrCl2",
"formula_anonymous": "AB2",
"energy": -34.78112247,
"energy_per_atom": -5.796853745,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32512247,
"band_gap": 0.7128999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.9997269,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:28.422000Z",
"spacegroup": 58
},
{
"id": "mp-862610",
"created_at": "2022-09-04T14:39:30.938273Z",
"structure_string": "Li1 Hf1 Ir2\n1.0\n0.000000 3.132453 3.132453\n3.132453 0.000000 3.132453\n3.132453 3.132453 0.000000\nLi Hf Ir\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Hf\n0.250000 0.250000 0.250000 Ir\n0.750000 0.750000 0.750000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Hf",
"Ir"
],
"chemical_system": "Hf-Ir-Li",
"density": 15.393500696199652,
"density_atomic": 0.06506932555163632,
"volume": 61.472897806905436,
"volume_molar": 9.254961087956994,
"formula_full": "Li1 Hf1 Ir2",
"formula_reduced": "LiHfIr2",
"formula_anonymous": "ABC2",
"energy": -32.32389778,
"energy_per_atom": -8.080974445,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32389778,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0015749,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:31.158000Z",
"spacegroup": 225
},
{
"id": "mp-1220314",
"created_at": "2022-09-04T14:42:11.081352Z",
"structure_string": "Nb1 O2 F1\n1.0\n3.909373 0.000000 0.000000\n0.000000 3.909373 0.000000\n0.000000 0.000000 4.155344\nNb O F\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"O",
"F"
],
"chemical_system": "F-Nb-O",
"density": 3.7626992290459644,
"density_atomic": 0.06298524025269418,
"volume": 63.506942006606074,
"volume_molar": 9.561193600023465,
"formula_full": "Nb1 O2 F1",
"formula_reduced": "NbO2F",
"formula_anonymous": "ABC2",
"energy": -34.15941246,
"energy_per_atom": -8.539853115,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32341246,
"band_gap": 0.89,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6.95e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.990000Z",
"spacegroup": 123
},
{
"id": "mp-1186350",
"created_at": "2022-09-04T14:40:42.795507Z",
"structure_string": "Ni1 Ir3\n1.0\n-1.898299 1.898299 3.812526\n1.898299 -1.898299 3.812526\n1.898299 1.898299 -3.812526\nNi Ir\n1 3\ndirect\n0.000000 0.000000 0.000000 Ni\n0.750000 0.250000 0.500000 Ir\n0.250000 0.750000 0.500000 Ir\n0.500000 0.500000 0.000000 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ni",
"Ir"
],
"chemical_system": "Ir-Ni",
"density": 19.19801207443626,
"density_atomic": 0.07278769188137217,
"volume": 54.95434594243096,
"volume_molar": 8.273570165976354,
"formula_full": "Ni1 Ir3",
"formula_reduced": "NiIr3",
"formula_anonymous": "AB3",
"energy": -32.32184702,
"energy_per_atom": -8.080461755,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32184702,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.2283473,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:08.783000Z",
"spacegroup": 139
},
{
"id": "mp-1187288",
"created_at": "2022-09-04T14:39:22.627116Z",
"structure_string": "Sr1 Eu3\n1.0\n-2.813548 2.813548 5.841775\n2.813548 -2.813548 5.841775\n2.813548 2.813548 -5.841775\nSr Eu\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.750000 0.250000 0.500000 Eu\n0.250000 0.750000 0.500000 Eu\n0.500000 0.500000 0.000000 Eu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Eu"
],
"chemical_system": "Eu-Sr",
"density": 4.879156629828673,
"density_atomic": 0.021624522016124473,
"volume": 184.9751868280544,
"volume_molar": 27.84866530464604,
"formula_full": "Sr1 Eu3",
"formula_reduced": "SrEu3",
"formula_anonymous": "AB3",
"energy": -32.32055591,
"energy_per_atom": -8.0801389775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32055591,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 22.1590864,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.419000Z",
"spacegroup": 139
},
{
"id": "mp-1187181",
"created_at": "2022-09-04T14:41:50.373838Z",
"structure_string": "Sr1 Eu3\n1.0\n0.000000 4.505465 4.505465\n4.505465 0.000000 4.505465\n4.505465 4.505465 0.000000\nSr Eu\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Eu\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Eu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Eu"
],
"chemical_system": "Eu-Sr",
"density": 4.934116257246558,
"density_atomic": 0.021868104209372855,
"volume": 182.91480421451286,
"volume_molar": 27.53846745169094,
"formula_full": "Sr1 Eu3",
"formula_reduced": "SrEu3",
"formula_anonymous": "AB3",
"energy": -32.32025029,
"energy_per_atom": -8.0800625725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.32025029,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 21.6021482,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:30.853000Z",
"spacegroup": 225
}
]
}