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=12167",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=12165",
"results": [
{
"id": "mp-10157",
"created_at": "2022-09-04T14:41:13.641272Z",
"structure_string": "K1\n1.0\n0.000000 3.327867 3.327867\n3.327867 0.000000 3.327867\n3.327867 3.327867 0.000000\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8808036242463018,
"density_atomic": 0.013566634377869216,
"volume": 73.71024914117724,
"volume_molar": 44.38934957828385,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -1.09807417,
"energy_per_atom": -1.09807417,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.09807417,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009049,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:12.917000Z",
"spacegroup": 225
},
{
"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
},
{
"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-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-1184804",
"created_at": "2022-09-04T14:43:59.573771Z",
"structure_string": "K8\n1.0\n4.535392 -6.424264 0.000000\n4.535392 6.424264 0.000000\n0.000000 0.000000 10.114030\nK\n8\ndirect\n0.745710 0.254290 0.500000 K\n0.254290 0.745710 0.500000 K\n0.763462 0.763462 0.263658 K\n0.263462 0.263462 0.236342 K\n0.754290 0.245710 0.000000 K\n0.245710 0.754290 0.000000 K\n0.736538 0.736538 0.763658 K\n0.236538 0.236538 0.736342 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8812609303512656,
"density_atomic": 0.013573678064514032,
"volume": 589.3759938888323,
"volume_molar": 44.3663149470431,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -8.74609609,
"energy_per_atom": -1.09326201125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.74609609,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001974,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:10.010000Z",
"spacegroup": 64
},
{
"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-1199937",
"created_at": "2022-09-04T14:43:05.016061Z",
"structure_string": "K81\n1.0\n-11.595292 -11.595292 11.595292\n-11.595292 11.595292 -11.595292\n11.595292 -11.595292 -11.595292\nK\n81\ndirect\n0.000000 0.000000 0.000000 K\n0.099949 0.500000 0.599949 K\n0.900051 0.500000 0.400051 K\n0.500000 0.599949 0.099949 K\n0.500000 0.400051 0.900051 K\n0.599949 0.099949 0.500000 K\n0.400051 0.900051 0.500000 K\n0.302565 0.500000 0.802565 K\n0.697435 0.500000 0.197435 K\n0.500000 0.802565 0.302565 K\n0.500000 0.197435 0.697435 K\n0.802565 0.302565 0.500000 K\n0.197435 0.697435 0.500000 K\n-0.000000 -0.000000 0.627555 K\n0.627555 -0.000000 -0.000000 K\n0.000000 0.627555 0.000000 K\n0.372445 0.372445 0.372445 K\n0.000000 0.000000 0.372445 K\n0.372445 0.000000 0.000000 K\n-0.000000 0.372445 -0.000000 K\n0.627555 0.627555 0.627555 K\n0.158734 0.060826 0.902092 K\n0.841266 0.939174 0.097908 K\n0.841266 0.743358 0.902092 K\n0.158734 0.256642 0.097908 K\n0.060826 0.902092 0.158734 K\n0.939174 0.097908 0.841266 K\n0.743358 0.902092 0.841266 K\n0.256642 0.097908 0.158734 K\n0.902092 0.158734 0.060826 K\n0.097908 0.841266 0.939174 K\n0.902092 0.841266 0.743358 K\n0.097908 0.158734 0.256642 K\n0.308045 0.122823 0.814777 K\n0.691955 0.877177 0.185223 K\n0.691955 0.506732 0.814777 K\n0.308045 0.493268 0.185223 K\n0.122823 0.814777 0.308045 K\n0.877177 0.185223 0.691955 K\n0.506732 0.814777 0.691955 K\n0.493268 0.185223 0.308045 K\n0.814777 0.308045 0.122823 K\n0.185223 0.691955 0.877177 K\n0.814777 0.691955 0.506732 K\n0.185223 0.308045 0.493268 K\n0.127557 0.825280 0.697723 K\n0.872443 0.174720 0.302277 K\n0.872443 0.570166 0.697723 K\n0.127557 0.429834 0.302277 K\n0.825280 0.697723 0.127557 K\n0.174720 0.302277 0.872443 K\n0.570166 0.697723 0.872443 K\n0.429834 0.302277 0.127557 K\n0.697723 0.127557 0.825280 K\n0.302277 0.872443 0.174720 K\n0.697723 0.872443 0.570166 K\n0.302277 0.127557 0.429834 K\n0.247295 0.211588 0.654606 K\n0.443018 0.788412 0.035707 K\n0.752705 0.407311 0.964293 K\n0.556982 0.592689 0.345394 K\n0.211588 0.654606 0.247295 K\n0.788412 0.035707 0.443018 K\n0.407311 0.964293 0.752705 K\n0.592689 0.345394 0.556982 K\n0.654606 0.247295 0.211588 K\n0.035707 0.443018 0.788412 K\n0.964293 0.752705 0.407311 K\n0.345394 0.556982 0.592689 K\n0.752705 0.788412 0.345394 K\n0.556982 0.211588 0.964293 K\n0.247295 0.592689 0.035707 K\n0.443018 0.407311 0.654606 K\n0.788412 0.345394 0.752705 K\n0.211588 0.964293 0.556982 K\n0.592689 0.035707 0.247295 K\n0.407311 0.654606 0.443018 K\n0.345394 0.752705 0.788412 K\n0.964293 0.556982 0.211588 K\n0.035707 0.247295 0.592689 K\n0.654606 0.443018 0.407311 K\n",
"nsites": 81,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8433093786697587,
"density_atomic": 0.012989126852912938,
"volume": 6235.984983227334,
"volume_molar": 46.36293746449536,
"formula_full": "K81",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -85.90866139,
"energy_per_atom": -1.0606007579012346,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -85.90866139,
"band_gap": 0.1197999999999999,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 4.5691797,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:10.326000Z",
"spacegroup": 204
},
{
"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-1184905",
"created_at": "2022-09-04T14:39:44.026482Z",
"structure_string": "K20\n1.0\n11.435131 0.000000 0.000000\n0.000000 11.435131 0.000000\n0.000000 0.000000 11.435131\nK\n20\ndirect\n0.875000 0.702742 0.047258 K\n0.062133 0.062133 0.062133 K\n0.202742 0.452742 0.125000 K\n0.812133 0.312133 0.187867 K\n0.452742 0.125000 0.202742 K\n0.547258 0.625000 0.297258 K\n0.187867 0.812133 0.312133 K\n0.797258 0.952742 0.375000 K\n0.937867 0.562133 0.437867 K\n0.125000 0.202742 0.452742 K\n0.625000 0.297258 0.547258 K\n0.437867 0.937867 0.562133 K\n0.297258 0.547258 0.625000 K\n0.687867 0.687867 0.687867 K\n0.047258 0.875000 0.702742 K\n0.952742 0.375000 0.797258 K\n0.312133 0.187867 0.812133 K\n0.702742 0.047258 0.875000 K\n0.562133 0.437867 0.937867 K\n0.375000 0.797258 0.952742 K\n",
"nsites": 20,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8683874434521244,
"density_atomic": 0.013375393355957815,
"volume": 1495.2831268391355,
"volume_molar": 45.02402732939104,
"formula_full": "K20",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -22.20797894,
"energy_per_atom": -1.110398947,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.20797894,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0563845,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.190000Z",
"spacegroup": 213
},
{
"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-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-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
}
]
}