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=61",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density&page=59",
"results": [
{
"id": "mp-1025271",
"created_at": "2022-09-04T14:46:35.121107Z",
"structure_string": "Al1 P1 Pt5\n1.0\n3.954535 0.000000 0.000000\n0.000000 3.954535 0.000000\n0.000000 0.000000 6.871166\nAl P Pt\n1 1 5\ndirect\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.500000 P\n0.000000 0.500000 0.286964 Pt\n0.000000 0.500000 0.713036 Pt\n0.500000 0.000000 0.286964 Pt\n0.500000 0.000000 0.713036 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"P",
"Pt"
],
"chemical_system": "Al-P-Pt",
"density": 15.969300246788096,
"density_atomic": 0.0651443495229465,
"volume": 107.45367865764496,
"volume_molar": 9.244302543659227,
"formula_full": "Al1 P1 Pt5",
"formula_reduced": "AlPPt5",
"formula_anonymous": "ABC5",
"energy": -43.7245868,
"energy_per_atom": -6.246369542857143,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.7245868,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.32e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:29.162000Z",
"spacegroup": 123
},
{
"id": "mp-1078828",
"created_at": "2022-09-04T14:42:00.857682Z",
"structure_string": "Os4 N4\n1.0\n1.386689 -6.333056 0.000000\n1.386689 6.333056 0.000000\n0.000000 0.000000 4.837136\nOs N\n4 4\ndirect\n0.462781 0.537219 0.676730 Os\n0.537219 0.462781 0.176730 Os\n0.154646 0.845354 0.576531 Os\n0.845354 0.154646 0.076531 Os\n0.862061 0.137939 0.503766 N\n0.137939 0.862061 0.003766 N\n0.770638 0.229362 0.672973 N\n0.229362 0.770638 0.172973 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Os",
"N"
],
"chemical_system": "N-Os",
"density": 15.967325582486538,
"density_atomic": 0.09416278489782973,
"volume": 84.95925443029654,
"volume_molar": 6.395457363048742,
"formula_full": "Os4 N4",
"formula_reduced": "OsN",
"formula_anonymous": "AB",
"energy": -75.09974102,
"energy_per_atom": -9.3874676275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -73.65574102,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000533,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.789000Z",
"spacegroup": 36
},
{
"id": "mp-1220415",
"created_at": "2022-09-04T14:45:11.227087Z",
"structure_string": "Ni4 W22 C8\n1.0\n3.953041 -6.998391 0.000000\n3.953041 6.998391 0.000000\n0.000000 0.000000 8.223958\nNi W C\n4 22 8\ndirect\n0.503565 0.496435 0.000000 Ni\n0.524237 0.057739 0.500000 Ni\n0.942261 0.475763 0.500000 Ni\n0.523171 0.476829 0.500000 Ni\n0.131911 0.244861 0.000000 W\n0.755139 0.868089 0.000000 W\n0.106717 0.893283 0.000000 W\n0.879523 0.766055 0.500000 W\n0.233945 0.120477 0.500000 W\n0.878794 0.121206 0.500000 W\n0.993994 0.006006 0.254439 W\n0.993994 0.006006 0.745561 W\n0.207927 0.422567 0.681793 W\n0.577433 0.792073 0.681793 W\n0.206208 0.793792 0.684613 W\n0.789154 0.582008 0.796024 W\n0.417992 0.210846 0.796024 W\n0.790441 0.209559 0.815408 W\n0.789154 0.582008 0.203976 W\n0.417992 0.210846 0.203976 W\n0.790441 0.209559 0.184592 W\n0.207927 0.422567 0.318207 W\n0.577433 0.792073 0.318207 W\n0.206208 0.793792 0.315387 W\n0.449587 0.916301 0.000000 W\n0.083699 0.550413 0.000000 W\n0.369577 0.630423 0.000000 C\n0.660213 0.339787 0.500000 C\n0.499305 0.000555 0.255890 C\n0.999445 0.500695 0.255890 C\n0.496782 0.503218 0.253211 C\n0.499305 0.000555 0.744110 C\n0.999445 0.500695 0.744110 C\n0.496782 0.503218 0.746789 C\n",
"nsites": 34,
"nelements": 3,
"elements": [
"Ni",
"W",
"C"
],
"chemical_system": "C-Ni-W",
"density": 15.966893333576925,
"density_atomic": 0.07472028436994754,
"volume": 455.03038815621505,
"volume_molar": 8.059579551629893,
"formula_full": "Ni4 W22 C8",
"formula_reduced": "Ni2W11C4",
"formula_anonymous": "A2B4C11",
"energy": -372.03336761,
"energy_per_atom": -10.942157870882355,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -372.03336761,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001224,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:50.160000Z",
"spacegroup": 38
},
{
"id": "mp-1184581",
"created_at": "2022-09-04T14:46:52.954737Z",
"structure_string": "Hf1 Mn1 Ir2\n1.0\n0.000000 3.179219 3.179219\n3.179219 0.000000 3.179219\n3.179219 3.179219 0.000000\nHf Mn Ir\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Mn\n0.750000 0.750000 0.750000 Ir\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Mn",
"Ir"
],
"chemical_system": "Hf-Ir-Mn",
"density": 15.964278059753386,
"density_atomic": 0.06223986756839106,
"volume": 64.26748893070311,
"volume_molar": 9.6756966158109,
"formula_full": "Hf1 Mn1 Ir2",
"formula_reduced": "HfMnIr2",
"formula_anonymous": "ABC2",
"energy": -39.28690123,
"energy_per_atom": -9.8217253075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.28690123,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.8995528,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:39.732000Z",
"spacegroup": 225
},
{
"id": "mp-997617",
"created_at": "2022-09-04T14:40:19.706958Z",
"structure_string": "B1 Os1\n1.0\n1.448176 -2.508315 0.000000\n1.448176 2.508315 0.000000\n0.000000 0.000000 2.879359\nB Os\n1 1\ndirect\n0.333333 0.666667 0.500000 B\n0.000000 0.000000 0.000000 Os\n",
"nsites": 2,
"nelements": 2,
"elements": [
"B",
"Os"
],
"chemical_system": "B-Os",
"density": 15.958956839078912,
"density_atomic": 0.0956094373793509,
"volume": 20.91843707922443,
"volume_molar": 6.298688628514639,
"formula_full": "B1 Os1",
"formula_reduced": "BOs",
"formula_anonymous": "AB",
"energy": -18.38046882,
"energy_per_atom": -9.19023441,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.38046882,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002179,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:54.860000Z",
"spacegroup": 187
},
{
"id": "mp-1183224",
"created_at": "2022-09-04T14:39:44.831630Z",
"structure_string": "Ag1 Au3\n1.0\n-2.076269 2.076269 4.216989\n2.076269 -2.076269 4.216989\n2.076269 2.076269 -4.216989\nAg Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Ag\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": [
"Ag",
"Au"
],
"chemical_system": "Ag-Au",
"density": 15.957040563477603,
"density_atomic": 0.05500856204576687,
"volume": 72.71595277607908,
"volume_molar": 10.947642577876524,
"formula_full": "Ag1 Au3",
"formula_reduced": "AgAu3",
"formula_anonymous": "AB3",
"energy": -12.80994115,
"energy_per_atom": -3.2024852875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.80994115,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002992,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:43.180000Z",
"spacegroup": 139
},
{
"id": "mp-1025306",
"created_at": "2022-09-04T14:43:42.050347Z",
"structure_string": "Al1 As1 Pt5\n1.0\n3.990624 0.000000 0.000000\n0.000000 3.990624 0.000000\n0.000000 0.000000 7.041642\nAl As Pt\n1 1 5\ndirect\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.500000 As\n0.000000 0.500000 0.273231 Pt\n0.000000 0.500000 0.726769 Pt\n0.500000 0.000000 0.273231 Pt\n0.500000 0.000000 0.726769 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"As",
"Pt"
],
"chemical_system": "Al-As-Pt",
"density": 15.952895609184614,
"density_atomic": 0.06242268975332574,
"volume": 112.13871154321824,
"volume_molar": 9.647358650832814,
"formula_full": "Al1 As1 Pt5",
"formula_reduced": "AlAsPt5",
"formula_anonymous": "ABC5",
"energy": -42.30034794,
"energy_per_atom": -6.042906848571429,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -42.30034794,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.008433,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:16.795000Z",
"spacegroup": 123
},
{
"id": "mp-1187199",
"created_at": "2022-09-04T14:46:29.883680Z",
"structure_string": "Ta3 Bi1\n1.0\n4.278221 0.000000 0.000000\n0.000000 4.278221 0.000000\n0.000000 0.000000 4.278221\nTa Bi\n3 1\ndirect\n0.000000 0.500000 0.500000 Ta\n0.500000 0.000000 0.500000 Ta\n0.500000 0.500000 0.000000 Ta\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"Bi"
],
"chemical_system": "Bi-Ta",
"density": 15.94320610304801,
"density_atomic": 0.051082288537315695,
"volume": 78.3050273301282,
"volume_molar": 11.789097419941974,
"formula_full": "Ta3 Bi1",
"formula_reduced": "Ta3Bi",
"formula_anonymous": "AB3",
"energy": -38.08674524,
"energy_per_atom": -9.52168631,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.08674524,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0099345,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:36.549000Z",
"spacegroup": 221
},
{
"id": "mp-641314",
"created_at": "2022-09-04T14:40:28.155684Z",
"structure_string": "Dy4 Ge6 Pt18\n1.0\n3.916450 6.759849 0.000000\n-3.916450 6.759849 0.000000\n0.000000 4.561331 9.047827\nDy Ge Pt\n4 6 18\ndirect\n0.244954 0.415768 0.250756 Dy\n0.584232 0.755046 0.249244 Dy\n0.755046 0.584232 0.749244 Dy\n0.415768 0.244954 0.750756 Dy\n0.819023 0.359316 0.502278 Ge\n0.640684 0.180977 0.997722 Ge\n0.359316 0.819023 0.002278 Ge\n0.180977 0.640684 0.497722 Ge\n0.000000 0.500000 0.000000 Ge\n0.500000 0.000000 0.500000 Ge\n0.197143 0.020989 0.429529 Pt\n0.306481 0.140461 0.078657 Pt\n0.640029 0.477691 0.077708 Pt\n0.522309 0.359971 0.422292 Pt\n0.859539 0.693519 0.421343 Pt\n0.915430 0.295745 0.256887 Pt\n0.704255 0.084570 0.243113 Pt\n0.802857 0.979011 0.570471 Pt\n0.477691 0.640029 0.577708 Pt\n0.866835 0.133165 0.750000 Pt\n0.979011 0.802857 0.070471 Pt\n0.295745 0.915430 0.756887 Pt\n0.359971 0.522309 0.922292 Pt\n0.133165 0.866835 0.250000 Pt\n0.693519 0.859539 0.921343 Pt\n0.084570 0.704255 0.743113 Pt\n0.020989 0.197143 0.929529 Pt\n0.140461 0.306481 0.578657 Pt\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Dy",
"Ge",
"Pt"
],
"chemical_system": "Dy-Ge-Pt",
"density": 15.93503382266051,
"density_atomic": 0.05844591557053681,
"volume": 479.07539349276766,
"volume_molar": 10.303783765235126,
"formula_full": "Dy4 Ge6 Pt18",
"formula_reduced": "Dy2(GePt3)3",
"formula_anonymous": "A2B3C9",
"energy": -177.20430789,
"energy_per_atom": -6.328725281785714,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -177.20430789,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.1e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:00.616000Z",
"spacegroup": 15
},
{
"id": "mp-864787",
"created_at": "2022-09-04T14:42:17.099051Z",
"structure_string": "Np1 Cd1 Pt2\n1.0\n0.000000 3.377705 3.377705\n3.377705 0.000000 3.377705\n3.377705 3.377705 0.000000\nNp Cd Pt\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.500000 0.500000 0.500000 Cd\n0.250000 0.250000 0.250000 Pt\n0.750000 0.750000 0.750000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Np",
"Cd",
"Pt"
],
"chemical_system": "Cd-Np-Pt",
"density": 15.934503013401688,
"density_atomic": 0.05189969975919316,
"volume": 77.07173680309137,
"volume_molar": 11.603421191147216,
"formula_full": "Np1 Cd1 Pt2",
"formula_reduced": "NpCdPt2",
"formula_anonymous": "ABC2",
"energy": -26.96309646,
"energy_per_atom": -6.740774115,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.96309646,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0027937,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:44.696000Z",
"spacegroup": 225
},
{
"id": "mp-1226653",
"created_at": "2022-09-04T14:40:16.943661Z",
"structure_string": "Ce1 Pt2 Au3\n1.0\n-2.740885 2.770302 3.847322\n2.740885 -2.770302 3.847322\n2.740885 2.770302 -3.847322\nCe Pt Au\n1 2 3\ndirect\n0.005944 0.005944 0.000000 Ce\n0.124909 0.374138 0.750771 Pt\n0.623367 0.374138 0.249229 Pt\n0.623379 0.872249 0.248870 Au\n0.623379 0.374509 0.751130 Au\n0.249022 0.749022 0.500000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Pt",
"Au"
],
"chemical_system": "Au-Ce-Pt",
"density": 15.932701457300183,
"density_atomic": 0.0513469667621972,
"volume": 116.85208257359685,
"volume_molar": 11.728328155955722,
"formula_full": "Ce1 Pt2 Au3",
"formula_reduced": "CePt2Au3",
"formula_anonymous": "AB2C3",
"energy": -31.398646070000005,
"energy_per_atom": -5.233107678333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.398646070000005,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.8506621,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.675000Z",
"spacegroup": 44
},
{
"id": "mp-2880",
"created_at": "2022-09-04T14:40:29.243203Z",
"structure_string": "Lu1 B2 Os3\n1.0\n2.759853 -4.780205 0.000000\n2.759853 4.780205 0.000000\n0.000000 0.000000 3.031391\nLu B Os\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Lu\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n0.500000 0.000000 0.500000 Os\n0.500000 0.500000 0.500000 Os\n0.000000 0.500000 0.500000 Os\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Lu",
"B",
"Os"
],
"chemical_system": "B-Lu-Os",
"density": 15.929347425938243,
"density_atomic": 0.075014777503694,
"volume": 79.98424043455356,
"volume_molar": 8.027939241309419,
"formula_full": "Lu1 B2 Os3",
"formula_reduced": "LuB2Os3",
"formula_anonymous": "AB2C3",
"energy": -53.63737556,
"energy_per_atom": -8.939562593333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -53.63737556,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0031862,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:59.601000Z",
"spacegroup": 191
}
]
}