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=29",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=elements&page=27",
"results": [
{
"id": "mp-1184755",
"created_at": "2022-09-04T14:41:36.653318Z",
"structure_string": "K2\n1.0\n2.379088 -4.120701 0.000000\n2.379088 4.120701 0.000000\n0.000000 0.000000 7.586569\nK\n2\ndirect\n0.333333 0.666667 0.250000 K\n0.666667 0.333333 0.750000 K\n",
"nsites": 2,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8729310679898711,
"density_atomic": 0.013445376824641508,
"volume": 148.75001467676051,
"volume_molar": 44.78967632177589,
"formula_full": "K2",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -2.19756261,
"energy_per_atom": -1.098781305,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.19756261,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0034722,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:32.041000Z",
"spacegroup": 194
},
{
"id": "mp-1180991",
"created_at": "2022-09-04T14:39:41.834755Z",
"structure_string": "K5\n1.0\n6.064214 0.000000 0.000000\n0.000000 6.064214 0.000000\n0.000000 0.000000 11.413700\nK\n5\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.695328 K\n0.000000 0.500000 0.695328 K\n0.000000 0.500000 0.304672 K\n0.500000 0.000000 0.304672 K\n",
"nsites": 5,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.7733952238279851,
"density_atomic": 0.011912269593852835,
"volume": 419.7352956635722,
"volume_molar": 50.55410064852499,
"formula_full": "K5",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -4.98716699,
"energy_per_atom": -0.9974333980000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.98716699,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0352015,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:29.186000Z",
"spacegroup": 123
},
{
"id": "mp-604325",
"created_at": "2022-09-04T14:41:17.501526Z",
"structure_string": "K2\n1.0\n3.129391 3.113852 0.000000\n-3.129391 3.113852 0.000000\n0.000000 2.991758 7.891759\nK\n2\ndirect\n0.363817 0.636183 0.750000 K\n0.636183 0.363817 0.250000 K\n",
"nsites": 2,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8442583443643122,
"density_atomic": 0.013003743357955325,
"volume": 153.8018665045751,
"volume_molar": 46.31082446206402,
"formula_full": "K2",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -2.07371566,
"energy_per_atom": -1.03685783,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.07371566,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024071,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:27.287000Z",
"spacegroup": 15
},
{
"id": "mp-1180961",
"created_at": "2022-09-04T14:46:53.432617Z",
"structure_string": "K2\n1.0\n-2.213986 2.213986 7.907082\n2.213986 -2.213986 7.907082\n2.213986 2.213986 -7.907082\nK\n2\ndirect\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n",
"nsites": 2,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8375504824566326,
"density_atomic": 0.012900425084217978,
"volume": 155.03365097997775,
"volume_molar": 46.6817234369069,
"formula_full": "K2",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -2.07759152,
"energy_per_atom": -1.03879576,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.07759152,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020308,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.111000Z",
"spacegroup": 141
},
{
"id": "mp-604318",
"created_at": "2022-09-04T14:40:39.078397Z",
"structure_string": "K4\n1.0\n2.352767 -4.075113 0.000000\n2.352767 4.075113 0.000000\n0.000000 0.000000 15.280084\nK\n4\ndirect\n0.000000 0.000000 0.000000 K\n0.333333 0.666667 0.750000 K\n0.000000 0.000000 0.500000 K\n0.666667 0.333333 0.250000 K\n",
"nsites": 4,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8863242870425809,
"density_atomic": 0.013651666741064489,
"volume": 293.0045155561789,
"volume_molar": 44.11286089987297,
"formula_full": "K4",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -4.39472201,
"energy_per_atom": -1.0986805025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.39472201,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0571651,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:03.834000Z",
"spacegroup": 194
},
{
"id": "mp-1080043",
"created_at": "2022-09-04T14:48:03.619925Z",
"structure_string": "K8\n1.0\n5.431928 0.000000 0.000000\n0.000000 10.817241 0.000000\n0.000000 0.000000 10.921951\nK\n8\ndirect\n0.250000 0.029858 0.838722 K\n0.250000 0.529858 0.661278 K\n0.750000 0.970142 0.161278 K\n0.750000 0.470142 0.338722 K\n0.250000 0.153668 0.432354 K\n0.250000 0.653668 0.067646 K\n0.750000 0.846332 0.567646 K\n0.750000 0.346332 0.932354 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8093310919806709,
"density_atomic": 0.012465774110476478,
"volume": 641.7571768187781,
"volume_molar": 48.30940065678613,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -8.37420842,
"energy_per_atom": -1.0467760525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.37420842,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0025668,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:26.628000Z",
"spacegroup": 62
},
{
"id": "mp-972981",
"created_at": "2022-09-04T14:42:04.406659Z",
"structure_string": "K2\n1.0\n2.387715 -4.017190 0.000000\n2.387715 4.017190 0.000000\n0.000000 0.000000 7.650362\nK\n2\ndirect\n0.820386 0.179614 0.250000 K\n0.179614 0.820386 0.750000 K\n",
"nsites": 2,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8847490924390605,
"density_atomic": 0.013627404705042282,
"volume": 146.7630882980953,
"volume_molar": 44.19139880517194,
"formula_full": "K2",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -2.20404441,
"energy_per_atom": -1.102022205,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.20404441,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001087,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.695000Z",
"spacegroup": 63
},
{
"id": "mp-1056027",
"created_at": "2022-09-04T14:41:05.189102Z",
"structure_string": "K1\n1.0\n10.140925 0.000000 0.000000\n0.000000 10.140925 0.000000\n0.000000 0.000000 4.220114\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.14959864075994236,
"density_atomic": 0.0023042026698664123,
"volume": 433.98960216376094,
"volume_molar": 261.35464726065686,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -0.61416936,
"energy_per_atom": -0.61416936,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -0.61416936,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.92e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:15.210000Z",
"spacegroup": 123
},
{
"id": "mp-998881",
"created_at": "2022-09-04T14:42:23.500908Z",
"structure_string": "K1\n1.0\n4.323110 0.000000 0.000000\n0.000000 4.323110 0.000000\n0.000000 0.000000 4.323110\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.803559636532303,
"density_atomic": 0.012376878897354294,
"volume": 80.79581357249621,
"volume_molar": 48.656376215229066,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -0.99023383,
"energy_per_atom": -0.99023383,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -0.99023383,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0042771,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:45.947000Z",
"spacegroup": 221
},
{
"id": "mp-573691",
"created_at": "2022-09-04T14:41:12.425213Z",
"structure_string": "K8\n1.0\n4.480404 -7.407795 0.000000\n4.480404 7.407795 0.000000\n0.000000 0.000000 8.914782\nK\n8\ndirect\n0.778657 0.221343 0.000000 K\n0.721343 0.278657 0.500000 K\n0.681016 0.681016 0.180153 K\n0.278657 0.721343 0.500000 K\n0.181016 0.181016 0.319847 K\n0.818984 0.818984 0.680153 K\n0.221343 0.778657 0.000000 K\n0.318984 0.318984 0.819847 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8777080958565258,
"density_atomic": 0.013518955303085275,
"volume": 591.7617020432232,
"volume_molar": 44.54590332601837,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -8.62728555,
"energy_per_atom": -1.07841069375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.62728555,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0081789,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:16.889000Z",
"spacegroup": 64
},
{
"id": "mp-1185201",
"created_at": "2022-09-04T14:45:08.858207Z",
"structure_string": "K29\n1.0\n-8.163698 8.163698 8.163698\n8.163698 -8.163698 8.163698\n8.163698 8.163698 -8.163698\nK\n29\ndirect\n0.000000 0.000000 0.000000 K\n0.634598 0.000000 0.000000 K\n0.373248 0.189882 0.000000 K\n0.189882 0.373248 0.000000 K\n0.682000 0.403644 0.000000 K\n0.000000 0.634598 0.000000 K\n0.403644 0.682000 0.000000 K\n0.810118 0.810118 0.183366 K\n0.373248 0.000000 0.189882 K\n0.000000 0.373248 0.189882 K\n0.596356 0.596356 0.278355 K\n0.721645 0.318000 0.318000 K\n0.318000 0.721645 0.318000 K\n0.365402 0.365402 0.365402 K\n0.189882 0.000000 0.373248 K\n0.000000 0.189882 0.373248 K\n0.682000 0.000000 0.403644 K\n0.000000 0.682000 0.403644 K\n0.596356 0.278355 0.596356 K\n0.278355 0.596356 0.596356 K\n0.816634 0.626752 0.626752 K\n0.626752 0.816634 0.626752 K\n0.000000 0.000000 0.634598 K\n0.403644 0.000000 0.682000 K\n0.000000 0.403644 0.682000 K\n0.318000 0.318000 0.721645 K\n0.810118 0.183366 0.810118 K\n0.183366 0.810118 0.810118 K\n0.626752 0.626752 0.816634 K\n",
"nsites": 29,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8651356075891992,
"density_atomic": 0.013325306745282366,
"volume": 2176.3101258638594,
"volume_molar": 45.19326177712234,
"formula_full": "K29",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -31.12487004,
"energy_per_atom": -1.0732713806896552,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.12487004,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.8306616,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:51.880000Z",
"spacegroup": 217
},
{
"id": "mp-58",
"created_at": "2022-09-04T14:47:28.022673Z",
"structure_string": "K1\n1.0\n-2.631059 2.631060 2.631060\n2.631059 -2.631060 2.631060\n2.631060 2.631060 -2.631059\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8911581989182845,
"density_atomic": 0.013726121379110086,
"volume": 72.85379258862663,
"volume_molar": 43.87357938685544,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -1.10082171,
"energy_per_atom": -1.10082171,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.10082171,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003526,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:14.452000Z",
"spacegroup": 229
}
]
}