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=1753",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density&page=1751",
"results": [
{
"id": "mp-1079507",
"created_at": "2022-09-04T14:40:25.577185Z",
"structure_string": "Ce2 Fe2 Sb4\n1.0\n4.338604 0.000000 0.000000\n0.000000 4.338604 0.000000\n0.000000 0.000000 9.645558\nCe Fe Sb\n2 2 4\ndirect\n0.000000 0.500000 0.734234 Ce\n0.500000 0.000000 0.265766 Ce\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n0.000000 0.500000 0.358483 Sb\n0.500000 0.000000 0.641517 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Fe",
"Sb"
],
"chemical_system": "Ce-Fe-Sb",
"density": 8.038810955236894,
"density_atomic": 0.044061837605900045,
"volume": 181.5630131351755,
"volume_molar": 13.667475273871947,
"formula_full": "Ce2 Fe2 Sb4",
"formula_reduced": "CeFeSb2",
"formula_anonymous": "ABC2",
"energy": -50.30622089,
"energy_per_atom": -6.28827761125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -49.53822089,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.2715352,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:57.306000Z",
"spacegroup": 129
},
{
"id": "mp-1184397",
"created_at": "2022-09-04T14:42:15.155586Z",
"structure_string": "Eu3 Tc1\n1.0\n-2.469120 2.469120 4.691788\n2.469120 -2.469120 4.691788\n2.469120 2.469120 -4.691788\nEu Tc\n3 1\ndirect\n0.750002 0.250001 0.500001 Eu\n0.250001 0.750002 0.500001 Eu\n0.499999 0.499999 0.000000 Eu\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Eu",
"Tc"
],
"chemical_system": "Eu-Tc",
"density": 8.038803704540387,
"density_atomic": 0.03496046699896831,
"volume": 114.41494760690813,
"volume_molar": 17.225572988420648,
"formula_full": "Eu3 Tc1",
"formula_reduced": "Eu3Tc",
"formula_anonymous": "AB3",
"energy": -39.38051473,
"energy_per_atom": -9.8451286825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.38051473,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 20.1322936,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:41.802000Z",
"spacegroup": 139
},
{
"id": "mp-758223",
"created_at": "2022-09-04T14:48:20.969565Z",
"structure_string": "Bi11 P1 O20\n1.0\n8.810500 0.000000 0.000000\n-2.724233 8.529044 0.000000\n-3.140357 -4.190291 7.283890\nBi P O\n11 1 20\ndirect\n0.298357 0.144397 0.494815 Bi\n0.720241 0.214377 0.860608 Bi\n0.159130 0.498309 0.287697 Bi\n0.212138 0.858423 0.708227 Bi\n0.473934 0.625123 0.785749 Bi\n0.491313 0.303059 0.148899 Bi\n0.808605 0.489725 0.666959 Bi\n0.851596 0.150824 0.374279 Bi\n0.665711 0.802671 0.521764 Bi\n0.340359 0.823997 0.125939 Bi\n0.850634 0.698734 0.203955 Bi\n0.002824 0.994222 0.002654 P\n0.988105 0.958963 0.813256 O\n0.003044 0.996480 0.412133 O\n0.371298 0.116511 0.742207 O\n0.240042 0.650560 0.845875 O\n0.243744 0.365041 0.571107 O\n0.184468 0.167406 0.163600 O\n0.625739 0.379072 0.753097 O\n0.407584 0.014069 0.009610 O\n0.993590 0.444008 0.011092 O\n0.390771 0.758106 0.640197 O\n0.116751 0.738340 0.370233 O\n0.837266 0.228072 0.624968 O\n0.621685 0.274371 0.378614 O\n0.602906 0.598415 0.601559 O\n0.387715 0.630860 0.264230 O\n0.833583 0.016894 0.003328 O\n0.998782 0.826312 0.024104 O\n0.736258 0.365068 0.116078 O\n0.767999 0.646354 0.392525 O\n0.629819 0.880320 0.237032 O\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Bi",
"P",
"O"
],
"chemical_system": "Bi-O-P",
"density": 8.03876032328771,
"density_atomic": 0.05846361818498911,
"volume": 547.3489495423702,
"volume_molar": 10.300663809319659,
"formula_full": "Bi11 P1 O20",
"formula_reduced": "Bi11PO20",
"formula_anonymous": "AB11C20",
"energy": -200.99816415,
"energy_per_atom": -6.2811926296875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -187.25816415,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0065183,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:23.606000Z",
"spacegroup": 1
},
{
"id": "mp-1193674",
"created_at": "2022-09-04T14:40:35.860702Z",
"structure_string": "Dy6 Zn23\n1.0\n0.000000 6.350281 6.350281\n6.350281 0.000000 6.350281\n6.350281 6.350281 0.000000\nDy Zn\n6 23\ndirect\n0.708075 0.708075 0.291925 Dy\n0.291925 0.708075 0.291925 Dy\n0.708075 0.291925 0.291925 Dy\n0.291925 0.291925 0.708075 Dy\n0.708075 0.291925 0.708075 Dy\n0.291925 0.708075 0.708075 Dy\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.500000 0.000000 Zn\n0.500000 0.000000 0.000000 Zn\n0.877770 0.877770 0.366689 Zn\n0.877770 0.366689 0.877770 Zn\n0.366689 0.877770 0.877770 Zn\n0.877770 0.877770 0.877770 Zn\n0.122230 0.122230 0.633311 Zn\n0.122230 0.633311 0.122230 Zn\n0.633311 0.122230 0.122230 Zn\n0.122230 0.122230 0.122230 Zn\n0.671455 0.671455 0.985635 Zn\n0.671455 0.985635 0.671455 Zn\n0.985635 0.671455 0.671455 Zn\n0.671455 0.671455 0.671455 Zn\n0.328545 0.328545 0.014365 Zn\n0.328545 0.014365 0.328545 Zn\n0.014365 0.328545 0.328545 Zn\n0.328545 0.328545 0.328545 Zn\n",
"nsites": 29,
"nelements": 2,
"elements": [
"Dy",
"Zn"
],
"chemical_system": "Dy-Zn",
"density": 8.038742086036791,
"density_atomic": 0.056622517213720726,
"volume": 512.1637367434583,
"volume_molar": 10.635593499436863,
"formula_full": "Dy6 Zn23",
"formula_reduced": "Dy6Zn23",
"formula_anonymous": "A6B23",
"energy": -65.75969471,
"energy_per_atom": -2.2675756796551725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.75969471,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0576685,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:55.355000Z",
"spacegroup": 225
},
{
"id": "mp-1009770",
"created_at": "2022-09-04T14:42:56.908935Z",
"structure_string": "Ru1 N1\n1.0\n0.000000 2.282137 2.282137\n2.282137 0.000000 2.282137\n2.282137 2.282137 0.000000\nRu N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.250000 0.250000 0.250000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ru",
"N"
],
"chemical_system": "N-Ru",
"density": 8.038617506614047,
"density_atomic": 0.08413464438476144,
"volume": 23.771420377718293,
"volume_molar": 7.1577419789875965,
"formula_full": "Ru1 N1",
"formula_reduced": "RuN",
"formula_anonymous": "AB",
"energy": -17.452562840000002,
"energy_per_atom": -8.726281420000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.09156284,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003072,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:07.296000Z",
"spacegroup": 216
},
{
"id": "mp-1183962",
"created_at": "2022-09-04T14:47:16.229503Z",
"structure_string": "Eu2 Cd1 Pb1\n1.0\n0.000000 4.008366 4.008366\n4.008366 0.000000 4.008366\n4.008366 4.008366 0.000000\nEu Cd Pb\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Eu\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Eu",
"Cd",
"Pb"
],
"chemical_system": "Cd-Eu-Pb",
"density": 8.038603630881845,
"density_atomic": 0.031054739219677923,
"volume": 128.8048169300159,
"volume_molar": 19.39201845296467,
"formula_full": "Eu2 Cd1 Pb1",
"formula_reduced": "Eu2CdPb",
"formula_anonymous": "ABC2",
"energy": -27.181286,
"energy_per_atom": -6.7953215,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.181286,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 14.0004135,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:04.084000Z",
"spacegroup": 225
},
{
"id": "mp-1079288",
"created_at": "2022-09-04T14:40:32.620101Z",
"structure_string": "Pr2 P4 Rh4\n1.0\n4.185490 0.000000 0.000000\n0.000000 4.185490 0.000000\n0.000000 0.000000 9.637989\nPr P Rh\n2 4 4\ndirect\n0.000000 0.500000 0.257626 Pr\n0.500000 0.000000 0.742374 Pr\n0.000000 0.000000 0.500000 P\n0.500000 0.500000 0.500000 P\n0.000000 0.500000 0.862233 P\n0.500000 0.000000 0.137767 P\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.500000 0.612412 Rh\n0.500000 0.000000 0.387588 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Pr",
"P",
"Rh"
],
"chemical_system": "P-Pr-Rh",
"density": 8.038383861051281,
"density_atomic": 0.059227166561248074,
"volume": 168.84143849189184,
"volume_molar": 10.167869087190548,
"formula_full": "Pr2 P4 Rh4",
"formula_reduced": "Pr(PRh)2",
"formula_anonymous": "AB2C2",
"energy": -71.61241219,
"energy_per_atom": -7.161241219,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -71.61241219,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002349,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:07.717000Z",
"spacegroup": 129
},
{
"id": "mp-777569",
"created_at": "2022-09-04T14:46:57.886629Z",
"structure_string": "Ta4 Cr2 N2 O10\n1.0\n4.765920 -0.005233 -0.008788\n-0.005238 4.765833 0.008777\n-0.017116 0.017092 9.238787\nTa Cr N O\n4 2 2 10\ndirect\n0.988266 0.011739 0.343597 Ta\n0.992472 0.007538 0.672958 Ta\n0.495668 0.504331 0.166859 Ta\n0.479534 0.520463 0.830031 Ta\n0.502658 0.497370 0.499217 Cr\n0.003230 0.996779 0.999998 Cr\n0.198043 0.801956 0.833016 N\n0.803339 0.196661 0.497530 N\n0.196280 0.803721 0.497852 O\n0.204686 0.795265 0.165119 O\n0.805813 0.194186 0.168894 O\n0.805539 0.194464 0.831841 O\n0.307104 0.300121 0.327527 O\n0.699877 0.692897 0.327527 O\n0.306909 0.301253 0.668242 O\n0.698748 0.693093 0.668244 O\n0.313209 0.301372 0.000775 O\n0.698623 0.686793 0.000775 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ta",
"Cr",
"N",
"O"
],
"chemical_system": "Cr-N-O-Ta",
"density": 8.038156745504136,
"density_atomic": 0.08577791121109232,
"volume": 209.8442331581553,
"volume_molar": 7.020619498625948,
"formula_full": "Ta4 Cr2 N2 O10",
"formula_reduced": "Ta2CrNO5",
"formula_anonymous": "ABC2D5",
"energy": -181.01754985,
"energy_per_atom": -10.056530547222222,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -169.42754985,
"band_gap": 1.4420000000000002,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:49.838000Z",
"spacegroup": 8
},
{
"id": "mp-569167",
"created_at": "2022-09-04T14:44:27.746948Z",
"structure_string": "Nb4 N3\n1.0\n-2.214605 2.214605 4.355904\n2.214605 -2.214605 4.355904\n2.214605 2.214605 -4.355904\nNb N\n4 3\ndirect\n0.000000 0.500000 0.500000 Nb\n0.746122 0.746122 0.000000 Nb\n0.253878 0.253878 0.000000 Nb\n0.500000 0.000000 0.500000 Nb\n0.250000 0.750000 0.500000 N\n0.750000 0.250000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Nb",
"N"
],
"chemical_system": "N-Nb",
"density": 8.037975613002434,
"density_atomic": 0.08191570941467523,
"volume": 85.45369441366209,
"volume_molar": 7.351631088872841,
"formula_full": "Nb4 N3",
"formula_reduced": "Nb4N3",
"formula_anonymous": "A3B4",
"energy": -72.90922001999999,
"energy_per_atom": -10.415602859999998,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -71.82622002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0028543,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:36.896000Z",
"spacegroup": 139
},
{
"id": "mp-1220337",
"created_at": "2022-09-04T14:47:42.195659Z",
"structure_string": "Nb6 Al1 Sb1\n1.0\n5.264287 0.000000 0.000000\n0.000000 5.264287 0.000000\n0.000000 0.000000 5.264287\nNb Al Sb\n6 1 1\ndirect\n0.000000 0.500000 0.750293 Nb\n0.500000 0.249707 0.000000 Nb\n0.750293 0.000000 0.500000 Nb\n0.000000 0.500000 0.249707 Nb\n0.500000 0.750293 0.000000 Nb\n0.249707 0.000000 0.500000 Nb\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nb",
"Al",
"Sb"
],
"chemical_system": "Al-Nb-Sb",
"density": 8.037957854704814,
"density_atomic": 0.05483670007638816,
"volume": 145.88769909305094,
"volume_molar": 10.981953238635965,
"formula_full": "Nb6 Al1 Sb1",
"formula_reduced": "Nb6AlSb",
"formula_anonymous": "ABC6",
"energy": -70.35814592999999,
"energy_per_atom": -8.794768241249999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -70.16614593,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.7705106,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:18.420000Z",
"spacegroup": 200
},
{
"id": "mp-1209967",
"created_at": "2022-09-04T14:39:30.448153Z",
"structure_string": "Nd4 Co6 Ge10\n1.0\n-2.949255 4.904023 5.917017\n2.949255 -4.904023 5.917017\n2.949255 4.904023 -5.917017\nNd Co Ge\n4 6 10\ndirect\n0.629707 0.865566 0.764141 Nd\n0.370293 0.134434 0.235859 Nd\n0.101426 0.365566 0.735859 Nd\n0.898574 0.634434 0.264141 Nd\n0.244935 0.637236 0.607699 Co\n0.755065 0.362764 0.392301 Co\n0.029536 0.137236 0.892301 Co\n0.970464 0.862764 0.107699 Co\n0.500000 0.750000 0.250000 Co\n0.500000 0.250000 0.750000 Co\n0.267951 0.017951 0.750000 Ge\n0.732049 0.982049 0.250000 Ge\n0.732049 0.482049 0.750000 Ge\n0.267951 0.517951 0.250000 Ge\n0.438939 0.597319 0.841619 Ge\n0.561061 0.402681 0.158381 Ge\n0.755700 0.097319 0.658381 Ge\n0.244300 0.902681 0.341619 Ge\n0.000000 0.750000 0.750000 Ge\n0.000000 0.250000 0.250000 Ge\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Nd",
"density": 8.037766211834555,
"density_atomic": 0.058425490156654394,
"volume": 342.3163408021848,
"volume_molar": 10.307385943794442,
"formula_full": "Nd4 Co6 Ge10",
"formula_reduced": "Nd2Co3Ge5",
"formula_anonymous": "A2B3C5",
"energy": -119.56086123,
"energy_per_atom": -5.9780430615,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -119.56086123,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.020586,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:30.679000Z",
"spacegroup": 72
},
{
"id": "mp-1225910",
"created_at": "2022-09-04T14:40:09.036407Z",
"structure_string": "Gd1 V2 Fe10\n1.0\n0.000000 0.000000 4.706450\n-4.254057 4.218150 2.353225\n-4.254057 -4.218150 -2.353225\nGd V Fe\n1 2 10\ndirect\n0.000000 0.000000 0.000000 Gd\n0.000000 0.358949 0.358949 V\n0.000000 0.641051 0.641051 V\n0.725768 0.774232 0.225768 Fe\n0.274232 0.225768 0.774232 Fe\n0.500000 0.772199 0.772199 Fe\n0.500000 0.227801 0.227801 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.640422 0.359578 0.640422 Fe\n0.359578 0.640422 0.359578 Fe\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Gd",
"V",
"Fe"
],
"chemical_system": "Fe-Gd-V",
"density": 8.037707190346,
"density_atomic": 0.07696523207558344,
"volume": 168.9074358566657,
"volume_molar": 7.824495031842401,
"formula_full": "Gd1 V2 Fe10",
"formula_reduced": "Gd(VFe5)2",
"formula_anonymous": "AB2C10",
"energy": -117.56917703000002,
"energy_per_atom": -9.04378284846154,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -117.56917703000002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 23.8994895,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:53.474000Z",
"spacegroup": 71
}
]
}