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=-density&page=15",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density&page=13",
"results": [
{
"id": "mp-30765",
"created_at": "2022-09-04T14:48:20.880564Z",
"structure_string": "Li1 Pt7\n1.0\n0.000000 3.934341 3.934341\n3.934341 0.000000 3.934341\n3.934341 3.934341 0.000000\nLi Pt\n1 7\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pt\n0.000000 0.500000 0.000000 Pt\n0.500000 0.000000 0.000000 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.000000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Pt"
],
"chemical_system": "Li-Pt",
"density": 18.712190711999263,
"density_atomic": 0.06568164107836937,
"volume": 121.79963637715201,
"volume_molar": 9.168681934750325,
"formula_full": "Li1 Pt7",
"formula_reduced": "LiPt7",
"formula_anonymous": "AB7",
"energy": -46.1786405,
"energy_per_atom": -5.7723300625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -46.1786405,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006617,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:26.998000Z",
"spacegroup": 225
},
{
"id": "mp-1983234",
"created_at": "2022-09-04T14:39:14.970650Z",
"structure_string": "U16\n1.0\n0.000000 0.000000 -5.061156\n0.000000 -5.868955 0.000000\n-11.380962 0.000000 0.000000\nU\n16\ndirect\n0.000000 0.215704 0.000000 U\n0.000000 0.784296 0.000000 U\n0.000000 0.281920 0.500000 U\n0.000000 0.718080 0.500000 U\n0.500000 0.283089 0.122605 U\n0.500000 0.283089 0.877395 U\n0.500000 0.716911 0.877395 U\n0.500000 0.716911 0.122605 U\n0.000000 0.222753 0.248627 U\n0.000000 0.222753 0.751373 U\n0.000000 0.777247 0.751373 U\n0.000000 0.777247 0.248627 U\n0.500000 0.223072 0.376107 U\n0.500000 0.223072 0.623893 U\n0.500000 0.776928 0.623893 U\n0.500000 0.776928 0.376107 U\n",
"nsites": 16,
"nelements": 1,
"elements": [
"U"
],
"chemical_system": "U",
"density": 18.707222485190716,
"density_atomic": 0.047329346285452274,
"volume": 338.05664467666554,
"volume_molar": 12.723904369351153,
"formula_full": "U16",
"formula_reduced": "U",
"formula_anonymous": "A",
"energy": -174.9898787,
"energy_per_atom": -10.93686741875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -174.9898787,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.0739257,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:42.421000Z",
"spacegroup": 47
},
{
"id": "mp-1197206",
"created_at": "2022-09-04T14:42:49.835794Z",
"structure_string": "U32\n1.0\n0.000000 0.000000 -5.061156\n0.000000 -5.868955 0.000000\n-22.761924 0.000000 0.000000\nU\n32\ndirect\n0.000000 0.215704 0.500000 U\n0.000000 0.215704 0.000000 U\n0.000000 0.784296 0.500000 U\n0.000000 0.784296 0.000000 U\n0.989198 0.281920 0.750000 U\n0.010802 0.281920 0.250000 U\n0.010802 0.718080 0.250000 U\n0.989198 0.718080 0.750000 U\n0.496094 0.283089 0.561302 U\n0.503906 0.283089 0.438698 U\n0.496094 0.283089 0.938698 U\n0.503906 0.283089 0.061302 U\n0.503906 0.716911 0.438698 U\n0.496094 0.716911 0.561302 U\n0.503906 0.716911 0.061302 U\n0.496094 0.716911 0.938698 U\n0.992340 0.222753 0.624313 U\n0.007660 0.222753 0.375687 U\n0.992340 0.222753 0.875687 U\n0.007660 0.222753 0.124313 U\n0.007660 0.777247 0.375687 U\n0.992340 0.777247 0.624313 U\n0.007660 0.777247 0.124313 U\n0.992340 0.777247 0.875687 U\n0.489469 0.223072 0.688054 U\n0.510531 0.223072 0.311946 U\n0.489469 0.223072 0.811946 U\n0.510531 0.223072 0.188054 U\n0.510531 0.776928 0.311946 U\n0.489469 0.776928 0.688054 U\n0.510531 0.776928 0.188054 U\n0.489469 0.776928 0.811946 U\n",
"nsites": 32,
"nelements": 1,
"elements": [
"U"
],
"chemical_system": "U",
"density": 18.707222485190716,
"density_atomic": 0.047329346285452274,
"volume": 676.1132893533311,
"volume_molar": 12.723904369351153,
"formula_full": "U32",
"formula_reduced": "U",
"formula_anonymous": "A",
"energy": -349.9526744,
"energy_per_atom": -10.936021075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -349.9526744,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0038817,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:51.165000Z",
"spacegroup": 51
},
{
"id": "mp-1226316",
"created_at": "2022-09-04T14:41:12.162809Z",
"structure_string": "Cr1 Ir3\n1.0\n8.841397 -1.352988 0.000000\n8.841397 1.352988 0.000000\n8.634351 0.000000 2.334280\nCr Ir\n1 3\ndirect\n0.000000 0.000000 0.000000 Cr\n0.254484 0.254484 0.254484 Ir\n0.500000 0.500000 0.500000 Ir\n0.745516 0.745516 0.745516 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Ir"
],
"chemical_system": "Cr-Ir",
"density": 18.692105889313893,
"density_atomic": 0.07162460006905229,
"volume": 55.84673416875843,
"volume_molar": 8.407922353764123,
"formula_full": "Cr1 Ir3",
"formula_reduced": "CrIr3",
"formula_anonymous": "AB3",
"energy": -36.584181,
"energy_per_atom": -9.14604525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -36.584181,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0107617,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:16.088000Z",
"spacegroup": 166
},
{
"id": "mp-300",
"created_at": "2022-09-04T14:47:09.455629Z",
"structure_string": "Yb1 Pt3\n1.0\n4.069387 0.000000 0.000000\n0.000000 4.069387 0.000000\n0.000000 0.000000 4.069387\nYb Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Pt"
],
"chemical_system": "Pt-Yb",
"density": 18.68523617589556,
"density_atomic": 0.05935714601972511,
"volume": 67.38868473680913,
"volume_molar": 10.145603627908203,
"formula_full": "Yb1 Pt3",
"formula_reduced": "YbPt3",
"formula_anonymous": "AB3",
"energy": -22.8564153,
"energy_per_atom": -5.714103825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.8564153,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001978,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:58.718000Z",
"spacegroup": 221
},
{
"id": "mp-1223662",
"created_at": "2022-09-04T14:39:18.046050Z",
"structure_string": "Ir1 Os1 Ru1\n1.0\n1.363628 -2.361872 0.000000\n1.363628 2.361872 0.000000\n0.000000 0.000000 6.673513\nIr Os Ru\n1 1 1\ndirect\n0.000000 0.000000 0.000769 Ir\n0.666667 0.333333 0.338124 Os\n0.333333 0.666667 0.661107 Ru\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ir",
"Os",
"Ru"
],
"chemical_system": "Ir-Os-Ru",
"density": 18.67772905995224,
"density_atomic": 0.06978859906583153,
"volume": 42.986964062283334,
"volume_molar": 8.629118280937721,
"formula_full": "Ir1 Os1 Ru1",
"formula_reduced": "IrOsRu",
"formula_anonymous": "ABC",
"energy": -29.24948605,
"energy_per_atom": -9.749828683333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.24948605,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017042,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:32.867000Z",
"spacegroup": 156
},
{
"id": "mp-20828",
"created_at": "2022-09-04T14:40:31.952550Z",
"structure_string": "Pt3 Pb1\n1.0\n4.132105 0.000000 0.000000\n0.000000 4.132105 0.000000\n0.000000 0.000000 4.132105\nPt Pb\n3 1\ndirect\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pt",
"Pb"
],
"chemical_system": "Pb-Pt",
"density": 18.65125316355883,
"density_atomic": 0.05669515475519634,
"volume": 70.55276623322708,
"volume_molar": 10.621967231596711,
"formula_full": "Pt3 Pb1",
"formula_reduced": "Pt3Pb",
"formula_anonymous": "AB3",
"energy": -22.25135587,
"energy_per_atom": -5.5628389675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.25135587,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.38e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:59.189000Z",
"spacegroup": 221
},
{
"id": "mp-12083",
"created_at": "2022-09-04T14:44:13.842056Z",
"structure_string": "Cr1 Ir3\n1.0\n3.825350 0.000000 0.000000\n0.000000 3.825350 0.000000\n0.000000 0.000000 3.825350\nCr Ir\n1 3\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Ir"
],
"chemical_system": "Cr-Ir",
"density": 18.64843893661112,
"density_atomic": 0.0714572765988082,
"volume": 55.97750418698037,
"volume_molar": 8.427610240187128,
"formula_full": "Cr1 Ir3",
"formula_reduced": "CrIr3",
"formula_anonymous": "AB3",
"energy": -37.13058195,
"energy_per_atom": -9.2826454875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -37.13058195,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.1705235,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:28.030000Z",
"spacegroup": 221
},
{
"id": "mp-1188112",
"created_at": "2022-09-04T14:40:28.829124Z",
"structure_string": "Pu4 Pt12\n1.0\n0.000000 0.000000 5.457007\n-5.202969 5.202969 2.728503\n-5.202969 -5.202969 2.728503\nPu Pt\n4 12\ndirect\n0.621047 0.252539 0.745508 Pu\n0.619094 0.747461 0.254492 Pu\n0.126414 0.254492 0.252539 Pu\n0.633446 0.745508 0.747461 Pu\n0.670490 0.150093 0.100939 Pt\n0.921523 0.849907 0.899061 Pt\n0.179416 0.899061 0.150093 Pt\n0.228571 0.100939 0.849907 Pt\n0.069600 0.360819 0.617064 Pt\n0.047484 0.639181 0.382936 Pt\n0.569580 0.382936 0.360819 Pt\n0.313335 0.617064 0.639181 Pt\n0.843218 0.458955 0.993487 Pt\n0.295660 0.541045 0.006513 Pt\n0.697827 0.006513 0.458955 Pt\n0.163295 0.993487 0.541045 Pt\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Pu",
"Pt"
],
"chemical_system": "Pt-Pu",
"density": 18.642692372877907,
"density_atomic": 0.054154306605783,
"volume": 295.4520333252942,
"volume_molar": 11.120335828207079,
"formula_full": "Pu4 Pt12",
"formula_reduced": "PuPt3",
"formula_anonymous": "AB3",
"energy": -138.53759976,
"energy_per_atom": -8.658599985,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -138.53759976,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 17.0178145,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:50.885000Z",
"spacegroup": 82
},
{
"id": "mp-790",
"created_at": "2022-09-04T14:43:52.892800Z",
"structure_string": "Lu1 Pt3\n1.0\n4.077847 0.000000 0.000000\n0.000000 4.077847 0.000000\n0.000000 0.000000 4.077847\nLu Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Lu\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Lu",
"Pt"
],
"chemical_system": "Lu-Pt",
"density": 18.616371449912947,
"density_atomic": 0.05898848060917395,
"volume": 67.80984962982613,
"volume_molar": 10.209011484631173,
"formula_full": "Lu1 Pt3",
"formula_reduced": "LuPt3",
"formula_anonymous": "AB3",
"energy": -27.0680926,
"energy_per_atom": -6.76702315,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.0680926,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0047747,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:19.331000Z",
"spacegroup": 221
},
{
"id": "mp-974395",
"created_at": "2022-09-04T14:45:27.764690Z",
"structure_string": "Pt3 Rh1\n1.0\n3.946907 0.000000 0.000000\n0.000000 3.946907 0.000000\n0.000000 0.000000 3.946907\nPt Rh\n3 1\ndirect\n0.500000 0.000000 0.000000 Pt\n0.000000 0.500000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pt",
"Rh"
],
"chemical_system": "Pt-Rh",
"density": 18.585158314384596,
"density_atomic": 0.06505629275553133,
"volume": 61.485212737701,
"volume_molar": 9.25681514412451,
"formula_full": "Pt3 Rh1",
"formula_reduced": "Pt3Rh",
"formula_anonymous": "AB3",
"energy": -25.58262412,
"energy_per_atom": -6.39565603,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.58262412,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.519545,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:09.952000Z",
"spacegroup": 221
},
{
"id": "mp-974616",
"created_at": "2022-09-04T14:48:23.371993Z",
"structure_string": "Pt3 Rh1\n1.0\n-1.971786 1.971786 3.955656\n1.971786 -1.971786 3.955656\n1.971786 1.971786 -3.955656\nPt Rh\n3 1\ndirect\n0.750000 0.250000 0.500000 Pt\n0.250000 0.750000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pt",
"Rh"
],
"chemical_system": "Pt-Rh",
"density": 18.5754301554511,
"density_atomic": 0.0650222398868474,
"volume": 61.5174132260109,
"volume_molar": 9.261663040953085,
"formula_full": "Pt3 Rh1",
"formula_reduced": "Pt3Rh",
"formula_anonymous": "AB3",
"energy": -25.59152647,
"energy_per_atom": -6.3978816175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.59152647,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.389569,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:33.201000Z",
"spacegroup": 139
}
]
}