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=12168",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=12166",
"results": [
{
"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-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-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-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-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-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-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-1060567",
"created_at": "2022-09-04T14:47:22.338461Z",
"structure_string": "Ir2\n1.0\n2.280203 0.000000 0.000000\n0.000000 7.194537 0.000000\n0.000000 0.000000 12.242584\nIr\n2\ndirect\n0.000000 0.163992 0.250000 Ir\n0.000000 0.836008 0.750000 Ir\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 3.1784942655438524,
"density_atomic": 0.009958193020686377,
"volume": 200.8396499089097,
"volume_molar": 60.47423209702877,
"formula_full": "Ir2",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"energy": -10.11504374,
"energy_per_atom": -5.05752187,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.11504374,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.3407752,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:08.202000Z",
"spacegroup": 51
},
{
"id": "mp-101",
"created_at": "2022-09-04T14:40:55.109337Z",
"structure_string": "Ir1\n1.0\n0.000000 1.937864 1.937864\n1.937864 0.000000 1.937864\n1.937864 1.937864 0.000000\nIr\n1\ndirect\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 21.930120199359056,
"density_atomic": 0.06870686295691784,
"volume": 14.554586790362457,
"volume_molar": 8.764977035519932,
"formula_full": "Ir1",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"energy": -8.83843042,
"energy_per_atom": -8.83843042,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.83843042,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003236,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:58.648000Z",
"spacegroup": 225
},
{
"id": "mp-1184502",
"created_at": "2022-09-04T14:42:39.769064Z",
"structure_string": "In3\n1.0\n8.523985 -1.666431 0.000000\n8.523985 1.666431 0.000000\n8.198199 0.000000 2.867898\nIn\n3\ndirect\n0.000000 0.000000 0.000000 In\n0.778336 0.778336 0.778336 In\n0.221664 0.221664 0.221664 In\n",
"nsites": 3,
"nelements": 1,
"elements": [
"In"
],
"chemical_system": "In",
"density": 7.020315339450969,
"density_atomic": 0.03682116668847311,
"volume": 81.47487626835985,
"volume_molar": 16.355105776388218,
"formula_full": "In3",
"formula_reduced": "In",
"formula_anonymous": "A",
"energy": -8.25505119,
"energy_per_atom": -2.75168373,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.25505119,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.011167,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:50.063000Z",
"spacegroup": 166
},
{
"id": "mp-1055994",
"created_at": "2022-09-04T14:40:27.916559Z",
"structure_string": "In1\n1.0\n-1.654892 1.654892 2.508362\n1.654892 -1.654892 2.508362\n1.654892 1.654892 -2.508362\nIn\n1\ndirect\n0.000000 0.000000 0.000000 In\n",
"nsites": 1,
"nelements": 1,
"elements": [
"In"
],
"chemical_system": "In",
"density": 6.938563351301882,
"density_atomic": 0.03639238202037771,
"volume": 27.478278268239098,
"volume_molar": 16.547805957378486,
"formula_full": "In1",
"formula_reduced": "In",
"formula_anonymous": "A",
"energy": -2.72188849,
"energy_per_atom": -2.72188849,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.72188849,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.47e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:59.508000Z",
"spacegroup": 139
}
]
}