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=12145",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density&page=12143",
"results": [
{
"id": "mp-20097",
"created_at": "2022-09-04T14:45:30.191619Z",
"structure_string": "Pt3 Pb1 C1\n1.0\n4.348043 0.000000 0.000000\n0.000000 4.348043 0.000000\n0.000000 0.000000 4.348043\nPt Pb C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pt",
"Pb",
"C"
],
"chemical_system": "C-Pb-Pt",
"density": 16.250754090700863,
"density_atomic": 0.06082589573398879,
"volume": 82.2018309745344,
"volume_molar": 9.900619937167482,
"formula_full": "Pt3 Pb1 C1",
"formula_reduced": "Pt3PbC",
"formula_anonymous": "ABC3",
"energy": -29.19826887,
"energy_per_atom": -5.839653774,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.19826887,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0209769,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:02.367000Z",
"spacegroup": 221
},
{
"id": "mp-1223755",
"created_at": "2022-09-04T14:39:44.904198Z",
"structure_string": "In8 Pt16\n1.0\n4.142531 0.000000 0.000000\n0.000000 5.754520 0.000000\n0.000000 0.923108 17.315401\nIn Pt\n8 16\ndirect\n0.500000 0.725432 0.238835 In\n0.500000 0.725084 0.575801 In\n0.500000 0.747803 0.916392 In\n0.500000 0.252197 0.083608 In\n0.500000 0.274916 0.424199 In\n0.500000 0.274568 0.761165 In\n0.000000 0.998984 0.331244 In\n0.000000 0.001016 0.668756 In\n0.000000 0.998544 0.167589 Pt\n0.000000 0.000000 0.500000 Pt\n0.000000 0.001456 0.832411 Pt\n0.000000 0.500000 0.000000 Pt\n0.000000 0.500907 0.333186 Pt\n0.000000 0.499093 0.666814 Pt\n0.000000 0.492264 0.165248 Pt\n0.000000 0.500000 0.500000 Pt\n0.000000 0.507736 0.834752 Pt\n0.500000 0.236840 0.255443 Pt\n0.500000 0.230674 0.589435 Pt\n0.500000 0.244172 0.920141 Pt\n0.500000 0.755828 0.079859 Pt\n0.500000 0.769326 0.410565 Pt\n0.500000 0.763160 0.744557 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 24,
"nelements": 2,
"elements": [
"In",
"Pt"
],
"chemical_system": "In-Pt",
"density": 16.252156586964084,
"density_atomic": 0.05814385427759283,
"volume": 412.7693338907014,
"volume_molar": 10.35731262542184,
"formula_full": "In8 Pt16",
"formula_reduced": "InPt2",
"formula_anonymous": "AB2",
"energy": -128.5150037,
"energy_per_atom": -5.354791820833333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -128.5150037,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0208861,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:42.409000Z",
"spacegroup": 10
},
{
"id": "mp-30853",
"created_at": "2022-09-04T14:45:07.405025Z",
"structure_string": "Tl8 Pt12\n1.0\n2.867603 -4.966834 0.000000\n2.867603 4.966834 0.000000\n0.000000 0.000000 14.259106\nTl Pt\n8 12\ndirect\n0.000000 0.000000 0.250000 Tl\n0.000000 0.000000 0.750000 Tl\n0.333333 0.666667 0.250000 Tl\n0.666667 0.333333 0.750000 Tl\n0.333333 0.666667 0.589330 Tl\n0.666667 0.333333 0.089330 Tl\n0.666667 0.333333 0.410670 Tl\n0.333333 0.666667 0.910670 Tl\n0.165399 0.330798 0.412771 Pt\n0.165399 0.834601 0.412771 Pt\n0.669202 0.834601 0.412771 Pt\n0.834601 0.165399 0.912771 Pt\n0.330798 0.165399 0.912771 Pt\n0.834601 0.669202 0.912771 Pt\n0.834601 0.669202 0.587229 Pt\n0.834601 0.165399 0.587229 Pt\n0.330798 0.165399 0.587229 Pt\n0.165399 0.834601 0.087229 Pt\n0.669202 0.834601 0.087229 Pt\n0.165399 0.330798 0.087229 Pt\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Tl",
"Pt"
],
"chemical_system": "Pt-Tl",
"density": 16.254837610034382,
"density_atomic": 0.04923897809980486,
"volume": 406.18227209063997,
"volume_molar": 12.230434083732268,
"formula_full": "Tl8 Pt12",
"formula_reduced": "Tl2Pt3",
"formula_anonymous": "A2B3",
"energy": -93.82740386,
"energy_per_atom": -4.691370193,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -93.82740386,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006923,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:49.052000Z",
"spacegroup": 194
},
{
"id": "mp-569120",
"created_at": "2022-09-04T14:39:07.409159Z",
"structure_string": "Nd1 Pt3\n1.0\n4.208141 0.000000 0.000000\n0.000000 4.208141 0.000000\n0.000000 0.000000 4.208141\nNd Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Nd\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": [
"Nd",
"Pt"
],
"chemical_system": "Nd-Pt",
"density": 16.255486527455492,
"density_atomic": 0.05367711209383505,
"volume": 74.51965733565257,
"volume_molar": 11.219196646556659,
"formula_full": "Nd1 Pt3",
"formula_reduced": "NdPt3",
"formula_anonymous": "AB3",
"energy": -26.37492536,
"energy_per_atom": -6.59373134,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.37492536,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0079483,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:37.702000Z",
"spacegroup": 221
},
{
"id": "mp-1199277",
"created_at": "2022-09-04T14:47:11.918099Z",
"structure_string": "Dy8 Au48\n1.0\n10.514028 0.000000 0.000000\n0.000000 10.514028 0.000000\n0.000000 0.000000 9.935467\nDy Au\n8 48\ndirect\n0.325465 0.825465 0.038081 Dy\n0.674535 0.825465 0.538081 Dy\n0.325465 0.174535 0.538081 Dy\n0.674535 0.174535 0.038081 Dy\n0.174535 0.674535 0.461919 Dy\n0.825465 0.674535 0.961919 Dy\n0.174535 0.325465 0.961919 Dy\n0.825465 0.325465 0.461919 Dy\n0.929932 0.762973 0.670665 Au\n0.070068 0.762973 0.170665 Au\n0.929932 0.237027 0.170665 Au\n0.070068 0.237027 0.670665 Au\n0.262973 0.429932 0.670665 Au\n0.262973 0.570068 0.170665 Au\n0.737027 0.429932 0.170665 Au\n0.737027 0.570068 0.670665 Au\n0.570068 0.737027 0.829335 Au\n0.429932 0.737027 0.329335 Au\n0.570068 0.262973 0.329335 Au\n0.429932 0.262973 0.829335 Au\n0.237027 0.070068 0.829335 Au\n0.237027 0.929932 0.329335 Au\n0.762973 0.070068 0.329335 Au\n0.762973 0.929932 0.829335 Au\n0.872755 0.050005 0.605105 Au\n0.127245 0.050005 0.105105 Au\n0.872755 0.949995 0.105105 Au\n0.127245 0.949995 0.605105 Au\n0.550005 0.372755 0.605105 Au\n0.550005 0.627245 0.105105 Au\n0.449995 0.372755 0.105105 Au\n0.449995 0.627245 0.605105 Au\n0.627245 0.449995 0.894895 Au\n0.372755 0.449995 0.394895 Au\n0.627245 0.550005 0.394895 Au\n0.372755 0.550005 0.894895 Au\n0.949995 0.127245 0.894895 Au\n0.949995 0.872755 0.394895 Au\n0.050005 0.127245 0.394895 Au\n0.050005 0.872755 0.894895 Au\n0.397220 0.897220 0.570574 Au\n0.602780 0.897220 0.070574 Au\n0.397220 0.102780 0.070574 Au\n0.602780 0.102780 0.570574 Au\n0.102780 0.602780 0.929426 Au\n0.897220 0.602780 0.429426 Au\n0.102780 0.397220 0.429426 Au\n0.897220 0.397220 0.929426 Au\n0.500000 0.000000 0.317563 Au\n0.500000 0.000000 0.817563 Au\n0.000000 0.500000 0.182437 Au\n0.000000 0.500000 0.682437 Au\n0.250000 0.750000 0.750000 Au\n0.750000 0.750000 0.250000 Au\n0.250000 0.250000 0.250000 Au\n0.750000 0.250000 0.750000 Au\n",
"nsites": 56,
"nelements": 2,
"elements": [
"Dy",
"Au"
],
"chemical_system": "Au-Dy",
"density": 16.259551054904946,
"density_atomic": 0.0509872375995974,
"volume": 1098.3140612513234,
"volume_molar": 11.811074777754877,
"formula_full": "Dy8 Au48",
"formula_reduced": "DyAu6",
"formula_anonymous": "AB6",
"energy": -216.94091998,
"energy_per_atom": -3.8739449996428568,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -216.94091998,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0051522,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:55.131000Z",
"spacegroup": 138
},
{
"id": "mp-865664",
"created_at": "2022-09-04T14:44:28.190238Z",
"structure_string": "Ti1 Re2 W1\n1.0\n0.000000 3.136240 3.136240\n3.136240 0.000000 3.136240\n3.136240 3.136240 0.000000\nTi Re W\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.250000 0.250000 0.250000 Re\n0.750000 0.750000 0.750000 Re\n0.000000 0.000000 0.000000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Re",
"W"
],
"chemical_system": "Re-Ti-W",
"density": 16.2597987409657,
"density_atomic": 0.06483389703798072,
"volume": 61.69612167006924,
"volume_molar": 9.28856822608108,
"formula_full": "Ti1 Re2 W1",
"formula_reduced": "TiRe2W",
"formula_anonymous": "ABC2",
"energy": -47.12082346,
"energy_per_atom": -11.780205865,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -47.12082346,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000882,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.434000Z",
"spacegroup": 225
},
{
"id": "mp-10115",
"created_at": "2022-09-04T14:42:14.366786Z",
"structure_string": "Th1 B2 Ir3\n1.0\n2.745212 -4.754846 0.000000\n2.745212 4.754846 0.000000\n0.000000 0.000000 3.247741\nTh B Ir\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Th\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"B",
"Ir"
],
"chemical_system": "B-Ir-Th",
"density": 16.261709275875457,
"density_atomic": 0.07076646838212343,
"volume": 84.78591820636456,
"volume_molar": 8.509878898409568,
"formula_full": "Th1 B2 Ir3",
"formula_reduced": "ThB2Ir3",
"formula_anonymous": "AB2C3",
"energy": -51.49400498,
"energy_per_atom": -8.582334163333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.49400498,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0063016,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:45.484000Z",
"spacegroup": 191
},
{
"id": "mp-1226000",
"created_at": "2022-09-04T14:47:38.123497Z",
"structure_string": "Co1 Os1\n1.0\n1.335637 -2.313391 0.000000\n1.335637 2.313391 0.000000\n0.000000 0.000000 4.116557\nCo Os\n1 1\ndirect\n0.666667 0.333333 0.500000 Co\n0.333333 0.666667 0.000000 Os\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Co",
"Os"
],
"chemical_system": "Co-Os",
"density": 16.264150208390014,
"density_atomic": 0.07861915715967258,
"volume": 25.439092356816733,
"volume_molar": 7.659889748969526,
"formula_full": "Co1 Os1",
"formula_reduced": "CoOs",
"formula_anonymous": "AB",
"energy": -18.05890061,
"energy_per_atom": -9.029450305,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.05890061,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.8978611,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:17.449000Z",
"spacegroup": 187
},
{
"id": "mp-1187624",
"created_at": "2022-09-04T14:42:09.158406Z",
"structure_string": "U3 Cl1\n1.0\n4.245442 0.000000 0.000000\n0.000000 4.245442 0.000000\n0.000000 0.000000 4.245442\nU Cl\n3 1\ndirect\n0.000000 0.500000 0.500000 U\n0.500000 0.000000 0.500000 U\n0.500000 0.500000 0.000000 U\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"Cl"
],
"chemical_system": "Cl-U",
"density": 16.265784690228678,
"density_atomic": 0.05227466461865135,
"volume": 76.51890316619686,
"volume_molar": 11.520190141691181,
"formula_full": "U3 Cl1",
"formula_reduced": "U3Cl",
"formula_anonymous": "AB3",
"energy": -35.3527548,
"energy_per_atom": -8.8381887,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -34.7387548,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.280362,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:39.430000Z",
"spacegroup": 221
},
{
"id": "mp-1184018",
"created_at": "2022-09-04T14:42:10.322393Z",
"structure_string": "Cu1 Au3\n1.0\n-2.011343 2.011343 4.128371\n2.011343 -2.011343 4.128371\n2.011343 2.011343 -4.128371\nCu Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Cu\n0.750000 0.250000 0.500000 Au\n0.250000 0.750000 0.500000 Au\n0.500000 0.500000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Au"
],
"chemical_system": "Au-Cu",
"density": 16.267159835275024,
"density_atomic": 0.05987547952685924,
"volume": 66.80531048115715,
"volume_molar": 10.057774580825793,
"formula_full": "Cu1 Au3",
"formula_reduced": "CuAu3",
"formula_anonymous": "AB3",
"energy": -13.97008309,
"energy_per_atom": -3.4925207725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.97008309,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002363,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:42.499000Z",
"spacegroup": 139
},
{
"id": "mp-568782",
"created_at": "2022-09-04T14:45:27.598325Z",
"structure_string": "Dy1 P2 Pt8\n1.0\n2.029973 6.006657 0.000000\n-2.029973 6.006657 0.000000\n0.000000 5.720035 7.471084\nDy P Pt\n1 2 8\ndirect\n0.500000 0.500000 0.500000 Dy\n0.058364 0.058364 0.709440 P\n0.941636 0.941636 0.290560 P\n0.223630 0.223630 0.413707 Pt\n0.823011 0.823011 0.844133 Pt\n0.176989 0.176989 0.155867 Pt\n0.166331 0.166331 0.847901 Pt\n0.474961 0.474961 0.868903 Pt\n0.525039 0.525039 0.131097 Pt\n0.776370 0.776370 0.586293 Pt\n0.833669 0.833669 0.152099 Pt\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Dy",
"P",
"Pt"
],
"chemical_system": "Dy-P-Pt",
"density": 16.26970535146106,
"density_atomic": 0.06037483760246596,
"volume": 182.19510704821695,
"volume_molar": 9.974587094796645,
"formula_full": "Dy1 P2 Pt8",
"formula_reduced": "Dy(PPt4)2",
"formula_anonymous": "AB2C8",
"energy": -70.98596736,
"energy_per_atom": -6.45326976,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -70.98596736,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.00523,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:55.966000Z",
"spacegroup": 12
},
{
"id": "mp-1037",
"created_at": "2022-09-04T14:46:42.761046Z",
"structure_string": "Pr1 Pt5\n1.0\n2.722561 -4.715614 0.000000\n2.722561 4.715614 0.000000\n0.000000 0.000000 4.435780\nPr Pt\n1 5\ndirect\n0.000000 0.000000 0.000000 Pr\n0.333333 0.666667 0.000000 Pt\n0.666667 0.333333 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Pt"
],
"chemical_system": "Pr-Pt",
"density": 16.275146917912725,
"density_atomic": 0.05267874122613795,
"volume": 113.89793796027422,
"volume_molar": 11.431823577841978,
"formula_full": "Pr1 Pt5",
"formula_reduced": "PrPt5",
"formula_anonymous": "AB5",
"energy": -39.3102257,
"energy_per_atom": -6.551704283333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.3102257,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0056303,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:43.763000Z",
"spacegroup": 191
}
]
}