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=52",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density&page=50",
"results": [
{
"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-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-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-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-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-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-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-973911",
"created_at": "2022-09-04T14:42:53.231397Z",
"structure_string": "Pa6 Re2\n1.0\n3.099729 -5.368888 0.000000\n3.099729 5.368888 0.000000\n0.000000 0.000000 5.400494\nPa Re\n6 2\ndirect\n0.176468 0.352935 0.250000 Pa\n0.647065 0.823532 0.250000 Pa\n0.176468 0.823532 0.250000 Pa\n0.823532 0.647065 0.750000 Pa\n0.352935 0.176468 0.750000 Pa\n0.823532 0.176468 0.750000 Pa\n0.333333 0.666667 0.750000 Re\n0.666667 0.333333 0.250000 Re\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pa",
"Re"
],
"chemical_system": "Pa-Re",
"density": 16.24620177467489,
"density_atomic": 0.04450598658803832,
"volume": 179.75109897125898,
"volume_molar": 13.53108024712016,
"formula_full": "Pa6 Re2",
"formula_reduced": "Pa3Re",
"formula_anonymous": "AB3",
"energy": -80.52030649,
"energy_per_atom": -10.06503831125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -80.52030649,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0277232,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:55.956000Z",
"spacegroup": 194
},
{
"id": "mp-867123",
"created_at": "2022-09-04T14:42:01.595535Z",
"structure_string": "Ta1 Ti1 Os2\n1.0\n0.000000 3.146154 3.146154\n3.146154 0.000000 3.146154\n3.146154 3.146154 0.000000\nTa Ti Os\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 Os\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Ti",
"Os"
],
"chemical_system": "Os-Ta-Ti",
"density": 16.243979914131312,
"density_atomic": 0.06422292255299755,
"volume": 62.283057839654525,
"volume_molar": 9.376933531840526,
"formula_full": "Ta1 Ti1 Os2",
"formula_reduced": "TaTiOs2",
"formula_anonymous": "ABC2",
"energy": -44.17574845,
"energy_per_atom": -11.0439371125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.17574845,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0015329,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:34.963000Z",
"spacegroup": 225
},
{
"id": "mp-631573",
"created_at": "2022-09-04T14:43:42.381502Z",
"structure_string": "Re2 Au1 Se1\n1.0\n0.000000 3.212097 3.212097\n3.212097 0.000000 3.212097\n3.212097 3.212097 0.000000\nRe Au Se\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Re\n0.500000 0.500000 0.500000 Au\n0.750000 0.750000 0.750000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Re",
"Au",
"Se"
],
"chemical_system": "Au-Re-Se",
"density": 16.242629734641746,
"density_atomic": 0.06034816100386707,
"volume": 66.28205289874008,
"volume_molar": 9.97899631044947,
"formula_full": "Re2 Au1 Se1",
"formula_reduced": "Re2AuSe",
"formula_anonymous": "ABC2",
"energy": -28.55565082,
"energy_per_atom": -7.138912705,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.08365082,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0021788,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:14.389000Z",
"spacegroup": 216
},
{
"id": "mp-1025324",
"created_at": "2022-09-04T14:48:25.455995Z",
"structure_string": "Si1 Sn1 Pt5\n1.0\n4.017644 0.000000 0.000000\n0.000000 4.017644 0.000000\n0.000000 0.000000 7.108830\nSi Sn Pt\n1 1 5\ndirect\n0.000000 0.000000 0.500000 Si\n0.500000 0.500000 0.000000 Sn\n0.000000 0.500000 0.295989 Pt\n0.000000 0.500000 0.704011 Pt\n0.500000 0.000000 0.295989 Pt\n0.500000 0.000000 0.704011 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Si",
"Sn",
"Pt"
],
"chemical_system": "Pt-Si-Sn",
"density": 16.239936559406324,
"density_atomic": 0.061003816779939865,
"volume": 114.74691862725938,
"volume_molar": 9.871744224994599,
"formula_full": "Si1 Sn1 Pt5",
"formula_reduced": "SiSnPt5",
"formula_anonymous": "ABC5",
"energy": -43.53865345,
"energy_per_atom": -6.219807635714285,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.53865345,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0042021,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:19.192000Z",
"spacegroup": 123
},
{
"id": "mp-481",
"created_at": "2022-09-04T14:42:09.448670Z",
"structure_string": "Sc1 Pt3\n1.0\n4.009359 0.000000 0.000000\n0.000000 4.009359 0.000000\n0.000000 0.000000 4.009359\nSc Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Sc\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": [
"Sc",
"Pt"
],
"chemical_system": "Pt-Sc",
"density": 16.237086859265233,
"density_atomic": 0.0620633418087794,
"volume": 64.45028391033506,
"volume_molar": 9.703217043250023,
"formula_full": "Sc1 Pt3",
"formula_reduced": "ScPt3",
"formula_anonymous": "AB3",
"energy": -28.70572707,
"energy_per_atom": -7.1764317675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.70572707,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000829,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:37.648000Z",
"spacegroup": 221
}
]
}