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_reduced&page=10221",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_reduced&page=10219",
"results": [
{
"id": "mp-27913",
"created_at": "2022-09-04T14:41:30.060815Z",
"structure_string": "Co1 H1 O2\n1.0\n2.720277 -0.015789 3.776559\n1.207079 2.437851 3.776559\n-0.025602 -0.015789 4.654208\nCo H O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 H\n0.407324 0.407324 0.407324 O\n0.592676 0.592676 0.592676 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 4.8805698547631104,
"density_atomic": 0.12787252314047548,
"volume": 31.28115330613884,
"volume_molar": 4.709487708617687,
"formula_full": "Co1 H1 O2",
"formula_reduced": "CoHO2",
"formula_anonymous": "ABC2",
"energy": -25.63318914,
"energy_per_atom": -6.408297285,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.62118914,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3e-07,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:27.068000Z",
"spacegroup": 166
},
{
"id": "mp-1276359",
"created_at": "2022-09-04T14:42:38.856641Z",
"structure_string": "Co1 H1 O2\n1.0\n2.696988 0.001965 3.800353\n1.042414 2.577097 3.924726\n-0.193627 0.115387 4.806877\nCo H O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 H\n0.389705 0.418642 0.418005 O\n0.610295 0.581358 0.581995 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 4.421306737319198,
"density_atomic": 0.11583967956676865,
"volume": 34.530482257544975,
"volume_molar": 5.198685616640461,
"formula_full": "Co1 H1 O2",
"formula_reduced": "CoHO2",
"formula_anonymous": "ABC2",
"energy": -25.21513887,
"energy_per_atom": -6.3037847175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.20313887,
"band_gap": 0.2849999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9999572,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:49.408000Z",
"spacegroup": 12
},
{
"id": "mp-1276248",
"created_at": "2022-09-04T14:43:49.517113Z",
"structure_string": "Co4 H4 O8\n1.0\n2.807608 -0.318604 4.059092\n-3.130429 5.292352 -0.408846\n-3.898567 -2.657859 1.940888\nCo H O\n4 4 8\ndirect\n0.999781 0.750038 0.500337 Co\n0.003732 0.493344 0.995533 Co\n0.000228 0.250653 0.500204 Co\n0.995639 0.007277 0.003559 Co\n0.460671 0.110785 0.746689 H\n0.541347 0.639502 0.753700 H\n0.457720 0.860219 0.246285 H\n0.539600 0.388454 0.254083 H\n0.227401 0.051795 0.709373 O\n0.217178 0.554901 0.700203 O\n0.225867 0.802209 0.205560 O\n0.219330 0.307545 0.203413 O\n0.781049 0.194301 0.794761 O\n0.773602 0.697579 0.794885 O\n0.783893 0.944345 0.299022 O\n0.772963 0.447053 0.292392 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 4.335147382843381,
"density_atomic": 0.11358227635836561,
"volume": 140.86704821373797,
"volume_molar": 5.302007454930229,
"formula_full": "Co4 H4 O8",
"formula_reduced": "CoHO2",
"formula_anonymous": "ABC2",
"energy": -100.60717874,
"energy_per_atom": -6.28794867125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -88.55917874,
"band_gap": 0.3367,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9876559,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.696000Z",
"spacegroup": 2
},
{
"id": "mp-1283838",
"created_at": "2022-09-04T14:41:17.149182Z",
"structure_string": "Co4 H4 O8\n1.0\n2.778453 -0.184450 3.983487\n-4.401290 2.694294 0.854091\n-2.357194 -5.199969 1.988962\nCo H O\n4 4 8\ndirect\n0.002406 0.496591 0.749992 Co\n0.998135 0.991403 0.497404 Co\n0.001535 0.508190 0.252582 Co\n0.997878 0.003734 0.000022 Co\n0.455541 0.985623 0.755268 H\n0.538720 0.009297 0.242838 H\n0.460014 0.489847 0.506947 H\n0.545233 0.515182 0.994799 H\n0.223746 0.901283 0.756164 O\n0.221439 0.917682 0.251086 O\n0.226965 0.412811 0.503892 O\n0.213307 0.398330 0.007718 O\n0.786943 0.101946 0.742267 O\n0.772406 0.086603 0.245843 O\n0.778888 0.582225 0.499121 O\n0.776843 0.599253 0.994058 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 4.286878826346007,
"density_atomic": 0.1123176244239928,
"volume": 142.45315534453334,
"volume_molar": 5.361705957443288,
"formula_full": "Co4 H4 O8",
"formula_reduced": "CoHO2",
"formula_anonymous": "ABC2",
"energy": -101.13980456,
"energy_per_atom": -6.321237785,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -89.09180456,
"band_gap": 0.4574,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9999518,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:15.987000Z",
"spacegroup": 2
},
{
"id": "mp-1292002",
"created_at": "2022-09-04T14:46:00.365287Z",
"structure_string": "Co4 H8 O8\n1.0\n-1.601880 2.792805 0.014471\n-4.804978 -2.786861 -0.010296\n1.577997 2.833965 9.508780\nCo H O\n4 8 8\ndirect\n0.189159 0.750262 0.499781 Co\n0.939418 0.000461 0.000255 Co\n0.689487 0.250026 0.500192 Co\n0.439624 0.499709 0.999824 Co\n0.291288 0.313474 0.288222 H\n0.032527 0.564385 0.787884 H\n0.798262 0.817586 0.287441 H\n0.535642 0.061754 0.788115 H\n0.834670 0.437707 0.212028 H\n0.569224 0.683834 0.712389 H\n0.335114 0.935159 0.212078 H\n0.078856 0.184891 0.711893 H\n0.241650 0.365080 0.390735 O\n0.991292 0.614019 0.890276 O\n0.750563 0.864952 0.389891 O\n0.489931 0.113646 0.890535 O\n0.886170 0.386266 0.109559 O\n0.626934 0.635864 0.609900 O\n0.388330 0.886123 0.109602 O\n0.136067 0.134800 0.609400 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.6353445123423973,
"density_atomic": 0.11776792299977311,
"volume": 169.8255305057773,
"volume_molar": 5.113566246737324,
"formula_full": "Co4 H8 O8",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -120.07355637,
"energy_per_atom": -6.0036778185,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -108.02555637,
"band_gap": 2.3933,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 12.0000545,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:21.098000Z",
"spacegroup": 164
},
{
"id": "mp-24105",
"created_at": "2022-09-04T14:40:53.338169Z",
"structure_string": "Co1 H2 O2\n1.0\n3.209436 -0.016355 0.004177\n-1.620302 2.788733 -0.019447\n0.001985 -0.034529 4.778382\nCo H O\n1 2 2\ndirect\n0.000186 0.938228 0.000036 Co\n0.655152 0.268379 0.576748 H\n0.344577 0.603863 0.423265 H\n0.659844 0.270086 0.780481 O\n0.340241 0.605499 0.219470 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.6197586267448405,
"density_atomic": 0.11726301421638147,
"volume": 42.63919048485032,
"volume_molar": 5.135584139844425,
"formula_full": "Co1 H2 O2",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -30.01979298,
"energy_per_atom": -6.0039585959999995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.00779298,
"band_gap": 2.3787000000000003,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.0000001,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:00.058000Z",
"spacegroup": 164
},
{
"id": "mp-625939",
"created_at": "2022-09-04T14:46:10.037574Z",
"structure_string": "Co1 H2 O2\n1.0\n1.618767 2.747186 0.000000\n-1.618767 2.747186 0.000000\n0.000000 0.247178 4.803423\nCo H O\n1 2 2\ndirect\n0.021916 0.978084 0.000000 Co\n0.816234 0.595242 0.585130 H\n0.404758 0.183766 0.414870 H\n0.719414 0.648377 0.780568 O\n0.351623 0.280586 0.219432 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.612728514359502,
"density_atomic": 0.11703527191265607,
"volume": 42.722163312710734,
"volume_molar": 5.145577620817038,
"formula_full": "Co1 H2 O2",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -29.95114298,
"energy_per_atom": -5.990228596,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.93914298,
"band_gap": 2.4449,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.0000028,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:22.086000Z",
"spacegroup": 5
},
{
"id": "mp-626708",
"created_at": "2022-09-04T14:47:13.168701Z",
"structure_string": "Co1 H2 O2\n1.0\n3.075284 0.000000 0.000000\n1.481483 2.902814 0.000000\n0.626346 0.600757 4.960750\nCo H O\n1 2 2\ndirect\n0.032940 0.969534 0.966167 Co\n0.432037 0.442179 0.572668 H\n0.485426 0.951485 0.354774 H\n0.396377 0.362727 0.768347 O\n0.589317 0.738527 0.219241 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.4852728564451785,
"density_atomic": 0.11290631300486116,
"volume": 44.28450338099984,
"volume_molar": 5.3337502569415385,
"formula_full": "Co1 H2 O2",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -29.846530820000005,
"energy_per_atom": -5.969306164000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.83453082,
"band_gap": 2.3773,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.9999675,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:54.064000Z",
"spacegroup": 1
},
{
"id": "mp-625943",
"created_at": "2022-09-04T14:41:46.616844Z",
"structure_string": "Co1 H2 O2\n1.0\n1.713250 -2.967436 0.000000\n1.713250 2.967436 0.000000\n0.000000 0.000000 4.440165\nCo H O\n1 2 2\ndirect\n0.666667 0.333333 0.985755 Co\n0.333333 0.666667 0.019188 H\n0.000000 0.000000 0.425238 H\n0.333333 0.666667 0.795504 O\n0.000000 0.000000 0.204516 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.4186713808643883,
"density_atomic": 0.1107487410275038,
"volume": 45.147240082469914,
"volume_molar": 5.437660694042957,
"formula_full": "Co1 H2 O2",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -28.96301069,
"energy_per_atom": -5.792602138,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.95101069,
"band_gap": 2.0404,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.0001623,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:25.478000Z",
"spacegroup": 156
},
{
"id": "mp-1272379",
"created_at": "2022-09-04T14:47:30.187585Z",
"structure_string": "Co4 H8 O8\n1.0\n-4.761827 2.876594 -0.340989\n-3.145009 -5.545437 -0.563054\n3.642100 0.189031 5.352679\nCo H O\n4 8 8\ndirect\n0.032916 0.976834 0.976305 Co\n0.534177 0.728945 0.976340 Co\n0.032651 0.476601 0.975970 Co\n0.534439 0.229145 0.976408 Co\n0.954530 0.554580 0.570644 H\n0.455839 0.306467 0.570093 H\n0.954670 0.054411 0.570720 H\n0.455881 0.806540 0.570091 H\n0.616639 0.647574 0.381798 H\n0.115656 0.397632 0.382288 H\n0.616905 0.147677 0.381993 H\n0.115976 0.897568 0.382447 H\n0.075164 0.641036 0.766523 O\n0.574970 0.392745 0.765983 O\n0.075230 0.141092 0.766571 O\n0.574916 0.892777 0.765987 O\n0.492450 0.563749 0.185810 O\n0.992843 0.312691 0.186337 O\n0.492815 0.063984 0.185978 O\n0.992629 0.812503 0.186503 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.494304442179086,
"density_atomic": 0.11319889355387529,
"volume": 176.68017214745393,
"volume_molar": 5.3199643308649955,
"formula_full": "Co4 H8 O8",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -119.9295368,
"energy_per_atom": -5.99647684,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -107.8815368,
"band_gap": 2.2674,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 3.64e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:09.528000Z",
"spacegroup": 12
},
{
"id": "mp-1276097",
"created_at": "2022-09-04T14:39:21.353234Z",
"structure_string": "Co2 H4 O4\n1.0\n-1.567876 -2.742039 -0.307148\n2.028820 -2.479023 5.019743\n-4.811722 2.881327 -0.224087\nCo H O\n2 4 4\ndirect\n0.982257 0.975687 0.029845 Co\n0.482202 0.975911 0.529949 Co\n0.536945 0.571754 0.957947 H\n0.038354 0.571902 0.457831 H\n0.907607 0.380504 0.620950 H\n0.409772 0.380390 0.121451 H\n0.521012 0.766650 0.073521 O\n0.021376 0.766830 0.573706 O\n0.941072 0.186401 0.490164 O\n0.441563 0.186364 0.990285 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.481781350489743,
"density_atomic": 0.11279320476900705,
"volume": 88.65782314173387,
"volume_molar": 5.339098904347068,
"formula_full": "Co2 H4 O4",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -59.96471866,
"energy_per_atom": -5.996471866,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -53.94071866,
"band_gap": 2.5222,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.03e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:38.831000Z",
"spacegroup": 5
},
{
"id": "mp-1273062",
"created_at": "2022-09-04T14:44:53.248523Z",
"structure_string": "Co2 H4 O4\n1.0\n-1.598211 2.768141 -0.000061\n-0.119420 -0.068988 4.802247\n4.840546 2.794673 -0.145308\nCo H O\n2 4 4\ndirect\n0.434388 0.000003 0.500002 Co\n0.934301 0.999999 0.999996 Co\n0.940556 0.580105 0.325540 H\n0.440211 0.579732 0.826329 H\n0.440218 0.420269 0.173669 H\n0.940548 0.419886 0.674473 H\n0.935532 0.782952 0.327604 O\n0.435404 0.782420 0.827784 O\n0.435465 0.217573 0.172212 O\n0.935485 0.217063 0.672391 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Co",
"H",
"O"
],
"chemical_system": "Co-H-O",
"density": 3.6006108420797784,
"density_atomic": 0.11664271679411645,
"volume": 85.73188515191039,
"volume_molar": 5.162894800049584,
"formula_full": "Co2 H4 O4",
"formula_reduced": "Co(HO)2",
"formula_anonymous": "AB2C2",
"energy": -60.04338175,
"energy_per_atom": -6.004338175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -54.01938175,
"band_gap": 2.3295000000000003,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.0003394,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.307000Z",
"spacegroup": 12
}
]
}