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=-structure_string&page=10398",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-structure_string&page=10396",
"results": [
{
"id": "mp-3972",
"created_at": "2022-09-04T14:47:14.727886Z",
"structure_string": "Ce2 S1 O2\n1.0\n1.976146 -3.422785 0.000000\n1.976146 3.422785 0.000000\n0.000000 0.000000 6.797867\nCe S O\n2 1 2\ndirect\n0.666667 0.333333 0.720143 Ce\n0.333333 0.666667 0.279857 Ce\n0.000000 0.000000 0.000000 S\n0.333333 0.666667 0.628876 O\n0.666667 0.333333 0.371124 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"S",
"O"
],
"chemical_system": "Ce-O-S",
"density": 6.2169806490647455,
"density_atomic": 0.05437117238113616,
"volume": 91.96049636286173,
"volume_molar": 11.075981069132428,
"formula_full": "Ce2 S1 O2",
"formula_reduced": "Ce2SO2",
"formula_anonymous": "AB2C2",
"energy": -43.05378966,
"energy_per_atom": -8.610757932,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -41.17678966,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0000731,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:02.536000Z",
"spacegroup": 164
},
{
"id": "mp-607",
"created_at": "2022-09-04T14:41:26.284244Z",
"structure_string": "Ce2 Ru4\n1.0\n0.000000 3.789407 3.789407\n3.789407 0.000000 3.789407\n3.789407 3.789407 0.000000\nCe Ru\n2 4\ndirect\n0.750000 0.750000 0.750000 Ce\n0.500000 0.500000 0.500000 Ce\n0.125000 0.125000 0.625000 Ru\n0.125000 0.625000 0.125000 Ru\n0.125000 0.125000 0.125000 Ru\n0.625000 0.125000 0.125000 Ru\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Ru"
],
"chemical_system": "Ce-Ru",
"density": 10.444470046690055,
"density_atomic": 0.05513247581328671,
"volume": 108.82877852828122,
"volume_molar": 10.923037050602918,
"formula_full": "Ce2 Ru4",
"formula_reduced": "CeRu2",
"formula_anonymous": "AB2",
"energy": -50.66413619,
"energy_per_atom": -8.444022698333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -50.66413619,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.01e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:24.449000Z",
"spacegroup": 227
},
{
"id": "mp-1226581",
"created_at": "2022-09-04T14:40:59.256114Z",
"structure_string": "Ce2 Ru2 Rh2\n1.0\n-2.547496 2.699907 3.967140\n2.547496 -2.699907 3.967140\n2.547496 2.699907 -3.967140\nCe Ru Rh\n2 2 2\ndirect\n0.373906 0.123906 0.250000 Ce\n0.626094 0.876094 0.750000 Ce\n0.000000 0.500000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.500000 0.500000 0.000000 Rh\n0.000000 0.500000 0.500000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Ru",
"Rh"
],
"chemical_system": "Ce-Rh-Ru",
"density": 10.470157234631115,
"density_atomic": 0.05497325043025236,
"volume": 109.14399190589131,
"volume_molar": 10.95467470609297,
"formula_full": "Ce2 Ru2 Rh2",
"formula_reduced": "CeRuRh",
"formula_anonymous": "ABC",
"energy": -48.135917250000006,
"energy_per_atom": -8.022652875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -48.135917250000006,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0263164,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:02.174000Z",
"spacegroup": 74
},
{
"id": "mp-951",
"created_at": "2022-09-04T14:39:43.426289Z",
"structure_string": "Ce2 Rh4\n1.0\n0.000000 3.795394 3.795394\n3.795394 0.000000 3.795394\n3.795394 3.795394 0.000000\nCe Rh\n2 4\ndirect\n0.500000 0.500000 0.500000 Ce\n0.750000 0.750000 0.750000 Ce\n0.125000 0.125000 0.125000 Rh\n0.625000 0.125000 0.125000 Rh\n0.125000 0.625000 0.125000 Rh\n0.125000 0.125000 0.625000 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Rh"
],
"chemical_system": "Ce-Rh",
"density": 10.506618373501277,
"density_atomic": 0.0548719829143367,
"volume": 109.34541967194605,
"volume_molar": 10.974891812095535,
"formula_full": "Ce2 Rh4",
"formula_reduced": "CeRh2",
"formula_anonymous": "AB2",
"energy": -45.60224681,
"energy_per_atom": -7.6003744683333325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -45.60224681,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.6971586,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:34.069000Z",
"spacegroup": 227
},
{
"id": "mp-1018117",
"created_at": "2022-09-04T14:47:17.390395Z",
"structure_string": "Ce2 Rh2\n1.0\n1.927367 -5.661466 0.000000\n1.927367 5.661466 0.000000\n0.000000 0.000000 4.035220\nCe Rh\n2 2\ndirect\n0.862987 0.137013 0.750000 Ce\n0.137013 0.862987 0.250000 Ce\n0.597156 0.402844 0.750000 Rh\n0.402844 0.597156 0.250000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"Rh"
],
"chemical_system": "Ce-Rh",
"density": 9.165016578153757,
"density_atomic": 0.045422334995421386,
"volume": 88.06240366998314,
"volume_molar": 13.258104764114478,
"formula_full": "Ce2 Rh2",
"formula_reduced": "CeRh",
"formula_anonymous": "AB",
"energy": -29.67798436,
"energy_per_atom": -7.41949609,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.67798436,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.041385,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:59.683000Z",
"spacegroup": 63
},
{
"id": "mp-1206583",
"created_at": "2022-09-04T14:47:39.027509Z",
"structure_string": "Ce2 Re4 Si2 C2\n1.0\n1.996695 -5.496486 0.000000\n1.996695 5.496486 0.000000\n0.000000 0.000000 7.321130\nCe Re Si C\n2 4 2 2\ndirect\n0.544911 0.455089 0.250000 Ce\n0.455089 0.544911 0.750000 Ce\n0.826872 0.173128 0.062167 Re\n0.173128 0.826872 0.937833 Re\n0.173128 0.826872 0.562167 Re\n0.826872 0.173128 0.437833 Re\n0.265416 0.734584 0.250000 Si\n0.734584 0.265416 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ce",
"Re",
"Si",
"C"
],
"chemical_system": "C-Ce-Re-Si",
"density": 11.421038441096124,
"density_atomic": 0.06222931625520146,
"volume": 160.69596456740993,
"volume_molar": 9.67733718188915,
"formula_full": "Ce2 Re4 Si2 C2",
"formula_reduced": "CeRe2SiC",
"formula_anonymous": "ABCD2",
"energy": -95.35489131,
"energy_per_atom": -9.535489131,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -95.35489131,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.2188981,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:14.313000Z",
"spacegroup": 63
},
{
"id": "mp-1025285",
"created_at": "2022-09-04T14:47:00.919696Z",
"structure_string": "Ce2 Re2 Si2 C1\n1.0\n2.053887 5.523747 0.000000\n-2.053887 5.523747 0.000000\n0.000000 4.334712 5.514916\nCe Re Si C\n2 2 2 1\ndirect\n0.429402 0.429402 0.298480 Ce\n0.570598 0.570598 0.701520 Ce\n0.792491 0.792491 0.093592 Re\n0.207509 0.207509 0.906408 Re\n0.855721 0.855721 0.688081 Si\n0.144279 0.144279 0.311919 Si\n0.000000 0.000000 0.000000 C\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Ce",
"Re",
"Si",
"C"
],
"chemical_system": "C-Ce-Re-Si",
"density": 9.565360502572437,
"density_atomic": 0.05593953058488121,
"volume": 125.13512227955471,
"volume_molar": 10.765447434104152,
"formula_full": "Ce2 Re2 Si2 C1",
"formula_reduced": "Ce2Re2Si2C",
"formula_anonymous": "AB2C2D2",
"energy": -60.57891385999999,
"energy_per_atom": -8.65413055142857,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -60.72091386000001,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.575376,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:49.880000Z",
"spacegroup": 12
},
{
"id": "mp-510122",
"created_at": "2022-09-04T14:39:05.939073Z",
"structure_string": "Ce2 Pu8 Co6\n1.0\n-2.868290 4.713552 5.690981\n2.868290 -4.713552 5.690981\n2.868290 4.713552 -5.690981\nCe Pu Co\n2 8 6\ndirect\n0.500000 0.750000 0.250000 Ce\n0.500000 0.250000 0.750000 Ce\n0.675898 0.769743 0.906155 Pu\n0.134321 0.920007 0.214314 Pu\n0.865679 0.079993 0.785686 Pu\n0.324102 0.230257 0.093845 Pu\n0.294307 0.579993 0.714314 Pu\n0.705693 0.420007 0.285686 Pu\n0.863589 0.269743 0.593845 Pu\n0.136411 0.730257 0.406155 Pu\n0.000000 0.250000 0.250000 Co\n0.000000 0.750000 0.750000 Co\n0.175108 0.333496 0.841612 Co\n0.491884 0.833496 0.658388 Co\n0.508116 0.166504 0.341612 Co\n0.824892 0.666504 0.158388 Co\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ce",
"Pu",
"Co"
],
"chemical_system": "Ce-Co-Pu",
"density": 13.951817132257803,
"density_atomic": 0.05198780655569032,
"volume": 307.7644751728561,
"volume_molar": 11.583756190115407,
"formula_full": "Ce2 Pu8 Co6",
"formula_reduced": "CePu4Co3",
"formula_anonymous": "AB3C4",
"energy": -163.25998014,
"energy_per_atom": -10.20374875875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -163.25998014,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 18.9721013,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:39.732000Z",
"spacegroup": 72
},
{
"id": "mp-1184000",
"created_at": "2022-09-04T14:46:35.709598Z",
"structure_string": "Ce2 Pu6\n1.0\n6.771678 0.008718 0.000000\n-3.378292 5.824242 0.000000\n0.000000 0.000000 5.212372\nCe Pu\n2 6\ndirect\n0.333575 0.666960 0.750001 Ce\n0.666647 0.333186 0.250000 Ce\n0.164068 0.328047 0.250000 Pu\n0.671677 0.835784 0.250000 Pu\n0.164125 0.835774 0.250000 Pu\n0.835958 0.672060 0.750001 Pu\n0.328184 0.164134 0.750001 Pu\n0.835765 0.164054 0.750001 Pu\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ce",
"Pu"
],
"chemical_system": "Ce-Pu",
"density": 14.078553737462192,
"density_atomic": 0.03888612631050026,
"volume": 205.72890022835196,
"volume_molar": 15.486604944689148,
"formula_full": "Ce2 Pu6",
"formula_reduced": "CePu3",
"formula_anonymous": "AB3",
"energy": -95.87112242,
"energy_per_atom": -11.9838903025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -95.87112242,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 33.8122089,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:32.359000Z",
"spacegroup": 194
},
{
"id": "mp-2109",
"created_at": "2022-09-04T14:47:45.122809Z",
"structure_string": "Ce2 Pt4\n1.0\n0.000000 3.885372 3.885372\n3.885372 0.000000 3.885372\n3.885372 3.885372 0.000000\nCe Pt\n2 4\ndirect\n0.750000 0.750000 0.750000 Ce\n0.500000 0.500000 0.500000 Ce\n0.125000 0.625000 0.125000 Pt\n0.125000 0.125000 0.625000 Pt\n0.625000 0.125000 0.125000 Pt\n0.125000 0.125000 0.125000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Pt"
],
"chemical_system": "Ce-Pt",
"density": 15.01273444986084,
"density_atomic": 0.051147385220451584,
"volume": 117.30804955403399,
"volume_molar": 11.774093111590798,
"formula_full": "Ce2 Pt4",
"formula_reduced": "CePt2",
"formula_anonymous": "AB2",
"energy": -42.1330184,
"energy_per_atom": -7.022169733333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -42.1330184,
"band_gap": 0.0089000000000005,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0075564,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:17.416000Z",
"spacegroup": 227
},
{
"id": "mp-1226551",
"created_at": "2022-09-04T14:43:10.325981Z",
"structure_string": "Ce2 Pt2 Rh2\n1.0\n-2.693617 2.739503 3.843473\n2.693617 -2.739503 3.843473\n2.693617 2.739503 -3.843473\nCe Pt Rh\n2 2 2\ndirect\n0.123596 0.873596 0.250000 Ce\n0.876404 0.126404 0.750000 Ce\n0.500000 0.500000 0.500000 Pt\n0.500000 0.000000 0.000000 Pt\n0.500000 0.500000 0.000000 Rh\n0.000000 0.500000 0.500000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Pt",
"Rh"
],
"chemical_system": "Ce-Pt-Rh",
"density": 12.82526501573008,
"density_atomic": 0.05288832340775529,
"volume": 113.44659110748421,
"volume_molar": 11.386522339857237,
"formula_full": "Ce2 Pt2 Rh2",
"formula_reduced": "CePtRh",
"formula_anonymous": "ABC",
"energy": -44.05943241,
"energy_per_atom": -7.343238735,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.05943241,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0028689,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:04.431000Z",
"spacegroup": 74
},
{
"id": "mp-21245",
"created_at": "2022-09-04T14:39:08.724684Z",
"structure_string": "Ce2 Pt2\n1.0\n1.927707 -5.548803 0.000000\n1.927707 5.548803 0.000000\n0.000000 0.000000 4.428339\nCe Pt\n2 2\ndirect\n0.863613 0.136387 0.250000 Ce\n0.136387 0.863613 0.750000 Ce\n0.594710 0.405290 0.250000 Pt\n0.405290 0.594710 0.750000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"Pt"
],
"chemical_system": "Ce-Pt",
"density": 11.750921281911207,
"density_atomic": 0.04222297257983535,
"volume": 94.73515850729802,
"volume_molar": 14.262711486296505,
"formula_full": "Ce2 Pt2",
"formula_reduced": "CePt",
"formula_anonymous": "AB",
"energy": -28.34696925,
"energy_per_atom": -7.0867423125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.34696925,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9925459,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:35.388000Z",
"spacegroup": 63
}
]
}