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=-formula_full&page=12165",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_full&page=12163",
"results": [
{
"id": "mp-1183245",
"created_at": "2022-09-04T14:46:16.161443Z",
"structure_string": "Ag1 Ge3\n1.0\n-2.102013 2.102013 4.461997\n2.102013 -2.102013 4.461997\n2.102013 2.102013 -4.461997\nAg Ge\n1 3\ndirect\n0.000000 0.000000 0.000000 Ag\n0.750000 0.250000 0.500000 Ge\n0.250000 0.750000 0.500000 Ge\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Ge"
],
"chemical_system": "Ag-Ge",
"density": 6.860004287321993,
"density_atomic": 0.05072241590914961,
"volume": 78.86059700240848,
"volume_molar": 11.87274038915345,
"formula_full": "Ag1 Ge3",
"formula_reduced": "AgGe3",
"formula_anonymous": "AB3",
"energy": -15.56050524,
"energy_per_atom": -3.89012631,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.56050524,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003613,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:22.498000Z",
"spacegroup": 139
},
{
"id": "mp-1229030",
"created_at": "2022-09-04T14:39:41.988025Z",
"structure_string": "Ag1 Ge1 Bi1 Te3\n1.0\n-2.179302 3.074033 6.547881\n2.179302 -3.074033 6.547881\n2.179302 3.074033 -6.547881\nAg Ge Bi Te\n1 1 1 3\ndirect\n0.999047 0.999047 0.000000 Ag\n0.671212 0.671212 0.000000 Ge\n0.332081 0.332081 0.000000 Bi\n0.829048 0.329048 0.500000 Te\n0.507444 0.007444 0.500000 Te\n0.161169 0.661169 0.500000 Te\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Ag",
"Ge",
"Bi",
"Te"
],
"chemical_system": "Ag-Bi-Ge-Te",
"density": 7.308731531874199,
"density_atomic": 0.03419515197598972,
"volume": 175.46346933076734,
"volume_molar": 17.611095175797065,
"formula_full": "Ag1 Ge1 Bi1 Te3",
"formula_reduced": "AgGeBiTe3",
"formula_anonymous": "ABCD3",
"energy": -22.62610907,
"energy_per_atom": -3.771018178333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.36010907,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0026604,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:25.015000Z",
"spacegroup": 44
},
{
"id": "mp-1096274",
"created_at": "2022-09-04T14:42:11.308793Z",
"structure_string": "Ag1 Ge1 Au2\n1.0\n-5.030517 5.586437 7.891633\n5.030517 -5.586437 7.891633\n5.030517 5.586437 -7.891633\nAg Ge Au\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ge\n0.000000 0.236851 0.236851 Au\n0.000000 0.763149 0.763149 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Ge",
"Au"
],
"chemical_system": "Ag-Au-Ge",
"density": 1.0752770697636704,
"density_atomic": 0.004509055629527099,
"volume": 887.1037149788972,
"volume_molar": 133.556586008046,
"formula_full": "Ag1 Ge1 Au2",
"formula_reduced": "AgGeAu2",
"formula_anonymous": "ABC2",
"energy": -8.89816545,
"energy_per_atom": -2.2245413625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.89816545,
"band_gap": 0.0131000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.99982,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.292000Z",
"spacegroup": 71
},
{
"id": "mp-7592",
"created_at": "2022-09-04T14:41:23.132941Z",
"structure_string": "Ag1 F1\n1.0\n0.000000 2.514648 2.514648\n2.514648 0.000000 2.514648\n2.514648 2.514648 0.000000\nAg F\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"F"
],
"chemical_system": "Ag-F",
"density": 6.624220955833901,
"density_atomic": 0.06288808879397713,
"volume": 31.802524744424137,
"volume_molar": 9.57596402671526,
"formula_full": "Ag1 F1",
"formula_reduced": "AgF",
"formula_anonymous": "AB",
"energy": -7.212117689999999,
"energy_per_atom": -3.6060588449999993,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.75011769,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0011883,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:19.210000Z",
"spacegroup": 225
},
{
"id": "mp-22993",
"created_at": "2022-09-04T14:42:26.895171Z",
"structure_string": "Ag1 Cl1 O4\n1.0\n-2.502987 2.502987 3.533556\n2.502987 -2.502987 3.533556\n2.502987 2.502987 -3.533556\nAg Cl O\n1 1 4\ndirect\n0.500000 0.500000 0.000000 Ag\n0.000000 0.000000 0.000000 Cl\n0.954768 0.954768 0.664573 O\n0.290195 0.290195 0.335427 O\n0.709805 0.045232 0.000000 O\n0.045232 0.709805 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 3.8877526507086957,
"density_atomic": 0.06775823623536825,
"volume": 88.55012074337522,
"volume_molar": 8.887688190526692,
"formula_full": "Ag1 Cl1 O4",
"formula_reduced": "AgClO4",
"formula_anonymous": "ABC4",
"energy": -26.96772795,
"energy_per_atom": -4.494621325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.21972795,
"band_gap": 2.6765,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6.29e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:45.888000Z",
"spacegroup": 121
},
{
"id": "mp-551758",
"created_at": "2022-09-04T14:42:38.183491Z",
"structure_string": "Ag1 Cl1 O4\n1.0\n0.000000 3.671931 3.671931\n3.671931 0.000000 3.671931\n3.671931 3.671931 0.000000\nAg Cl O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Cl\n0.115272 0.115272 0.654185 O\n0.115272 0.115272 0.115272 O\n0.115272 0.654185 0.115272 O\n0.654185 0.115272 0.115272 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 3.4767563227761213,
"density_atomic": 0.060595129736078016,
"volume": 99.01785879711768,
"volume_molar": 9.938324723834114,
"formula_full": "Ag1 Cl1 O4",
"formula_reduced": "AgClO4",
"formula_anonymous": "ABC4",
"energy": -26.26816978,
"energy_per_atom": -4.378028296666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.52016978,
"band_gap": 2.3744,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:04.558000Z",
"spacegroup": 216
},
{
"id": "mp-1178561",
"created_at": "2022-09-04T14:46:12.454847Z",
"structure_string": "Ag1 Cl1 O3\n1.0\n3.340779 -2.746660 0.000000\n3.340779 2.746660 0.000000\n1.082580 0.000000 4.187238\nAg Cl O\n1 1 3\ndirect\n0.023337 0.023337 0.023337 Ag\n0.505484 0.505484 0.505484 Cl\n0.864992 0.423093 0.423093 O\n0.423093 0.864992 0.423093 O\n0.423093 0.423093 0.864992 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 4.1342602849418615,
"density_atomic": 0.0650668394919739,
"volume": 76.84405818753127,
"volume_molar": 9.255314699498877,
"formula_full": "Ag1 Cl1 O3",
"formula_reduced": "AgClO3",
"formula_anonymous": "ABC3",
"energy": -21.29892259,
"energy_per_atom": -4.259784518,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.23792259,
"band_gap": 2.7117,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0010287,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:23.213000Z",
"spacegroup": 160
},
{
"id": "mp-996984",
"created_at": "2022-09-04T14:41:52.881649Z",
"structure_string": "Ag1 Cl1 O2\n1.0\n4.275880 0.000000 0.000000\n-2.124498 3.854806 0.000000\n-0.053721 -1.141606 6.573875\nAg Cl O\n1 1 2\ndirect\n0.859940 0.460940 0.053510 Ag\n0.532810 0.809750 0.047220 Cl\n0.162860 0.094050 0.572980 O\n0.299400 0.350580 0.485140 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 2.6867736649012284,
"density_atomic": 0.03691564956853246,
"volume": 108.35512978240182,
"volume_molar": 16.3132460904423,
"formula_full": "Ag1 Cl1 O2",
"formula_reduced": "AgClO2",
"formula_anonymous": "ABC2",
"energy": -15.67515322,
"energy_per_atom": -3.918788305,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.35315322,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9999148,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:30.698000Z",
"spacegroup": 1
},
{
"id": "mp-22922",
"created_at": "2022-09-04T14:43:13.335905Z",
"structure_string": "Ag1 Cl1\n1.0\n0.000000 2.811198 2.811198\n2.811198 0.000000 2.811198\n2.811198 2.811198 0.000000\nAg Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl",
"density": 5.356180845292489,
"density_atomic": 0.04501172889637266,
"volume": 44.4328633677782,
"volume_molar": 13.379047878530397,
"formula_full": "Ag1 Cl1",
"formula_reduced": "AgCl",
"formula_anonymous": "AB",
"energy": -6.14884946,
"energy_per_atom": -3.07442473,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.53484946,
"band_gap": 0.9522000000000002,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001499,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:03.435000Z",
"spacegroup": 225
},
{
"id": "mp-726265",
"created_at": "2022-09-04T14:43:04.206249Z",
"structure_string": "Ag1 Cl1\n1.0\n3.433973 0.000000 0.000000\n0.000000 3.433973 0.000000\n0.000000 0.000000 3.433973\nAg Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl",
"density": 5.877178819441274,
"density_atomic": 0.049390038786442075,
"volume": 40.49399533067414,
"volume_molar": 12.193026990805121,
"formula_full": "Ag1 Cl1",
"formula_reduced": "AgCl",
"formula_anonymous": "AB",
"energy": -5.87539735,
"energy_per_atom": -2.937698675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.26139735,
"band_gap": 0.6022000000000001,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001168,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:56.686000Z",
"spacegroup": 221
},
{
"id": "mp-1183000",
"created_at": "2022-09-04T14:39:08.777775Z",
"structure_string": "Ag1 C8 S4 N4 Cl1\n1.0\n-6.806679 6.806679 2.779571\n6.806679 -6.806679 2.779571\n6.806679 6.806679 -2.779571\nAg C S N Cl\n1 8 4 4 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.856045 0.526135 0.810143 C\n0.715991 0.045901 0.189857 C\n0.954099 0.143955 0.670090 C\n0.473865 0.284009 0.329910 C\n0.840375 0.506302 0.938787 C\n0.567516 0.901588 0.061213 C\n0.098412 0.159625 0.665928 C\n0.493698 0.432484 0.334072 C\n0.826864 0.504086 0.091796 S\n0.412291 0.735067 0.908204 S\n0.264933 0.173136 0.677224 S\n0.495914 0.587709 0.322776 S\n0.878551 0.564949 0.696872 N\n0.868077 0.181679 0.303128 N\n0.818321 0.121449 0.686399 N\n0.435051 0.131923 0.313601 N\n0.750000 0.250000 0.500000 Cl\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Ag",
"C",
"S",
"N",
"Cl"
],
"chemical_system": "Ag-C-Cl-N-S",
"density": 1.3658175794819418,
"density_atomic": 0.03494332294407402,
"volume": 515.1198707921563,
"volume_molar": 17.234024278796547,
"formula_full": "Ag1 C8 S4 N4 Cl1",
"formula_reduced": "AgC8S4N4Cl",
"formula_anonymous": "ABC4D4E8",
"energy": -114.55933147,
"energy_per_atom": -6.364407303888889,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -110.48933147,
"band_gap": 0.0003999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0007296,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:39.955000Z",
"spacegroup": 82
},
{
"id": "mp-1183010",
"created_at": "2022-09-04T14:47:18.141537Z",
"structure_string": "Ag1 C8 S4 N4 Cl1\n1.0\n0.000000 0.000000 -5.111396\n-6.826357 -6.826357 -2.555698\n-6.826357 6.826357 -2.555698\nAg C S N Cl\n1 8 4 4 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.547972 0.322015 0.193719 C\n0.063707 0.677985 0.806281 C\n0.130013 0.806281 0.322015 C\n0.258308 0.193719 0.677985 C\n0.571168 0.309753 0.060007 C\n0.940927 0.690247 0.939993 C\n0.119079 0.939993 0.309753 C\n0.368826 0.060007 0.690247 C\n0.684079 0.238969 0.913510 S\n0.836558 0.761031 0.086490 S\n0.076952 0.086490 0.238969 S\n0.402411 0.913510 0.761031 S\n0.559241 0.313635 0.313026 N\n0.185903 0.686365 0.686974 N\n0.127123 0.686974 0.313635 N\n0.127733 0.313026 0.686365 N\n0.250000 0.500000 0.500000 Cl\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Ag",
"C",
"S",
"N",
"Cl"
],
"chemical_system": "Ag-C-Cl-N-S",
"density": 1.4769081363039254,
"density_atomic": 0.03778548375777505,
"volume": 476.3734167171056,
"volume_molar": 15.937709832180818,
"formula_full": "Ag1 C8 S4 N4 Cl1",
"formula_reduced": "AgC8S4N4Cl",
"formula_anonymous": "ABC4D4E8",
"energy": -115.17748422,
"energy_per_atom": -6.398749123333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -111.10748422,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9571676,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:05.150000Z",
"spacegroup": 82
}
]
}