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=is_stable&page=2",
"previous": null,
"results": [
{
"id": "mp-755356",
"created_at": "2022-09-04T14:45:26.972297Z",
"structure_string": "Li2 Fe1 F4\n1.0\n2.987778 -4.353807 0.000000\n2.987778 4.353807 0.000000\n0.000000 0.000000 2.983443\nLi Fe F\n2 1 4\ndirect\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Fe\n0.242176 0.242176 0.500000 F\n0.764974 0.235026 0.000000 F\n0.235026 0.764974 0.000000 F\n0.757824 0.757824 0.500000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.1174884093970183,
"density_atomic": 0.09018468674653872,
"volume": 77.6184987998382,
"volume_molar": 6.677564647893098,
"formula_full": "Li2 Fe1 F4",
"formula_reduced": "Li2FeF4",
"formula_anonymous": "AB2C4",
"energy": -39.68828367,
"energy_per_atom": -5.66975481,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.58428367,
"band_gap": 3.5017,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0001148,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:55.068000Z",
"spacegroup": 65
},
{
"id": "mp-22010",
"created_at": "2022-09-04T14:45:26.972300Z",
"structure_string": "Ta4 Cu2 O12\n1.0\n4.794611 0.000000 0.000000\n0.000000 4.794611 0.000000\n0.000000 0.000000 9.164897\nTa Cu O\n4 2 12\ndirect\n0.000000 0.000000 0.668477 Ta\n0.500000 0.500000 0.168477 Ta\n0.500000 0.500000 0.831523 Ta\n0.000000 0.000000 0.331523 Ta\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.203979 0.796021 0.824118 O\n0.703979 0.703979 0.324118 O\n0.812457 0.187543 0.500000 O\n0.296021 0.296021 0.675882 O\n0.796021 0.203979 0.824118 O\n0.187543 0.812457 0.500000 O\n0.312457 0.312457 0.000000 O\n0.687543 0.687543 0.000000 O\n0.296021 0.296021 0.324118 O\n0.203979 0.796021 0.175882 O\n0.703979 0.703979 0.675882 O\n0.796021 0.203979 0.175882 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ta",
"Cu",
"O"
],
"chemical_system": "Cu-O-Ta",
"density": 8.219540892026062,
"density_atomic": 0.08543545993319038,
"volume": 210.68535259335889,
"volume_molar": 7.048760274374657,
"formula_full": "Ta4 Cu2 O12",
"formula_reduced": "Ta2CuO6",
"formula_anonymous": "AB2C6",
"energy": -164.37812926000004,
"energy_per_atom": -9.132118292222223,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -156.13412926,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0000149,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:10.613000Z",
"spacegroup": 136
},
{
"id": "mp-770346",
"created_at": "2022-09-04T14:45:27.068537Z",
"structure_string": "Li8 V4 B4 O16\n1.0\n4.714190 0.000000 0.000000\n0.000000 5.889225 0.000000\n0.000000 0.000000 10.903937\nLi V B O\n8 4 4 16\ndirect\n0.194701 0.995691 0.581523 Li\n0.305299 0.995691 0.081523 Li\n0.305299 0.504309 0.081523 Li\n0.194701 0.504309 0.581523 Li\n0.694701 0.495691 0.918477 Li\n0.805299 0.495691 0.418477 Li\n0.805299 0.004309 0.418477 Li\n0.694701 0.004309 0.918477 Li\n0.195327 0.250000 0.820069 V\n0.304673 0.250000 0.320069 V\n0.695327 0.750000 0.679931 V\n0.804673 0.750000 0.179931 V\n0.673173 0.250000 0.661781 B\n0.826827 0.250000 0.161781 B\n0.326827 0.750000 0.338219 B\n0.173173 0.750000 0.838219 B\n0.774034 0.039921 0.596822 O\n0.725966 0.039921 0.096822 O\n0.357312 0.250000 0.661312 O\n0.729037 0.250000 0.294983 O\n0.142688 0.250000 0.161312 O\n0.770963 0.250000 0.794983 O\n0.725966 0.460079 0.096822 O\n0.774034 0.460079 0.596822 O\n0.274034 0.539921 0.903178 O\n0.225966 0.539921 0.403178 O\n0.642688 0.750000 0.338688 O\n0.857312 0.750000 0.838688 O\n0.270963 0.750000 0.705017 O\n0.229037 0.750000 0.205017 O\n0.225966 0.960079 0.403178 O\n0.274034 0.960079 0.903178 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Li",
"V",
"B",
"O"
],
"chemical_system": "B-Li-O-V",
"density": 3.0636968888270357,
"density_atomic": 0.1057064323568372,
"volume": 302.72519170807305,
"volume_molar": 5.697042862700002,
"formula_full": "Li8 V4 B4 O16",
"formula_reduced": "Li2VBO4",
"formula_anonymous": "ABC2D4",
"energy": -237.82446603,
"energy_per_atom": -7.4320145634375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -220.03246603,
"band_gap": 1.7394000000000005,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 8.0026458,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:58.551000Z",
"spacegroup": 62
},
{
"id": "mp-15178",
"created_at": "2022-09-04T14:45:27.073221Z",
"structure_string": "Lu8 C14\n1.0\n13.530328 0.000000 0.000000\n0.000000 3.604646 0.000000\n0.000000 1.660520 6.067985\nLu C\n8 14\ndirect\n0.945766 0.365516 0.259892 Lu\n0.445766 0.634484 0.240108 Lu\n0.054234 0.634484 0.740108 Lu\n0.554234 0.365516 0.759892 Lu\n0.659929 0.056860 0.339845 Lu\n0.159929 0.943140 0.160155 Lu\n0.340071 0.943140 0.660155 Lu\n0.840071 0.056860 0.839845 Lu\n0.500000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n0.786201 0.462538 0.076116 C\n0.286201 0.537462 0.423884 C\n0.213799 0.537462 0.923884 C\n0.713799 0.462538 0.576116 C\n0.197483 0.377771 0.455178 C\n0.697483 0.622229 0.044822 C\n0.396497 0.267911 0.949810 C\n0.896497 0.732089 0.550190 C\n0.603503 0.732089 0.050190 C\n0.103503 0.267911 0.449810 C\n0.302517 0.377771 0.955178 C\n0.802517 0.622229 0.544822 C\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Lu",
"C"
],
"chemical_system": "C-Lu",
"density": 8.797273222734885,
"density_atomic": 0.07433737767990013,
"volume": 295.94802354655184,
"volume_molar": 8.101093888368771,
"formula_full": "Lu8 C14",
"formula_reduced": "Lu4C7",
"formula_anonymous": "A4B7",
"energy": -172.50825015,
"energy_per_atom": -7.841284097727273,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -172.50825015,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024266,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:00.583000Z",
"spacegroup": 14
},
{
"id": "mp-1223829",
"created_at": "2022-09-04T14:45:27.078302Z",
"structure_string": "Ho4 Si3 Ge1\n1.0\n3.851796 0.000000 0.000000\n0.000000 4.257068 0.000000\n0.000000 0.000000 10.515806\nHo Si Ge\n4 3 1\ndirect\n0.000000 0.000000 0.139174 Ho\n0.000000 0.500000 0.640854 Ho\n0.500000 0.500000 0.359239 Ho\n0.500000 0.000000 0.860096 Ho\n0.000000 0.500000 0.922184 Si\n0.500000 0.500000 0.078025 Si\n0.500000 0.000000 0.580246 Si\n0.000000 0.000000 0.420183 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ho",
"Si",
"Ge"
],
"chemical_system": "Ge-Ho-Si",
"density": 7.864144742327949,
"density_atomic": 0.04639525395754092,
"volume": 172.4314303208962,
"volume_molar": 12.980079310507112,
"formula_full": "Ho4 Si3 Ge1",
"formula_reduced": "Ho4Si3Ge",
"formula_anonymous": "AB3C4",
"energy": -45.63664198,
"energy_per_atom": -5.7045802475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -45.84964198,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004524,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:10.332000Z",
"spacegroup": 25
},
{
"id": "mp-1213643",
"created_at": "2022-09-04T14:45:27.099580Z",
"structure_string": "Er4 V8 O8\n1.0\n-4.422695 4.422695 -4.607848\n4.422695 -4.422695 -4.607848\n-4.422695 -4.422695 4.607848\nEr V O\n4 8 8\ndirect\n0.875000 0.125000 0.250000 Er\n0.875000 0.625000 0.750000 Er\n0.375000 0.125000 0.250000 Er\n0.875000 0.125000 0.750000 Er\n0.510196 0.192819 0.682623 V\n0.510196 0.827573 0.317377 V\n0.577573 0.760196 0.817377 V\n0.239804 0.422427 0.182623 V\n0.239804 0.057181 0.817377 V\n0.942819 0.760196 0.182623 V\n0.172427 0.489804 0.682623 V\n0.807181 0.489804 0.317377 V\n0.662884 0.512938 0.850054 O\n0.662884 0.812830 0.149946 O\n0.562830 0.912884 0.649946 O\n0.087116 0.437170 0.350054 O\n0.087116 0.737062 0.649946 O\n0.262938 0.912884 0.350054 O\n0.187170 0.337116 0.850054 O\n0.487062 0.337116 0.149946 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Er",
"V",
"O"
],
"chemical_system": "Er-O-V",
"density": 5.548129276923884,
"density_atomic": 0.05547507257711174,
"volume": 360.52228633319044,
"volume_molar": 10.855579777077486,
"formula_full": "Er4 V8 O8",
"formula_reduced": "ErV2O2",
"formula_anonymous": "AB2C2",
"energy": -151.96747561,
"energy_per_atom": -7.5983737805,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -132.87147561,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 24.1586666,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:07.735000Z",
"spacegroup": 141
},
{
"id": "mp-779539",
"created_at": "2022-09-04T14:45:27.109898Z",
"structure_string": "Li4 Cu2 P2 O8\n1.0\n5.066610 0.000000 0.000000\n-0.029189 5.383258 0.000000\n-0.000514 -0.027556 6.242901\nLi Cu P O\n4 2 2 8\ndirect\n0.995164 0.672935 0.245774 Li\n0.493910 0.327506 0.250207 Li\n0.993853 0.154791 0.500540 Li\n0.493463 0.324682 0.749660 Li\n0.488964 0.819713 0.998361 Cu\n0.993052 0.664585 0.761383 Cu\n0.997910 0.183494 0.004934 P\n0.499916 0.831242 0.494231 P\n0.907920 0.905557 0.014776 O\n0.304842 0.199653 0.000430 O\n0.890390 0.319872 0.206841 O\n0.388131 0.684640 0.296046 O\n0.807685 0.830231 0.487296 O\n0.394672 0.100295 0.498656 O\n0.407649 0.683138 0.698034 O\n0.885072 0.297667 0.792831 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cu",
"P",
"O"
],
"chemical_system": "Cu-Li-O-P",
"density": 3.362525829236095,
"density_atomic": 0.09396602690347923,
"volume": 170.2743058024046,
"volume_molar": 6.408848983458533,
"formula_full": "Li4 Cu2 P2 O8",
"formula_reduced": "Li2CuPO4",
"formula_anonymous": "ABC2D4",
"energy": -102.96908481,
"energy_per_atom": -6.435567800625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -97.47308481,
"band_gap": 0.9082999999999996,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.37e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:05.783000Z",
"spacegroup": 1
},
{
"id": "mp-23850",
"created_at": "2022-09-04T14:45:27.349489Z",
"structure_string": "Na4 H8 N4\n1.0\n0.000000 4.339695 5.566081\n4.100092 0.000000 5.566081\n4.100092 4.339695 0.000000\nNa H N\n4 8 4\ndirect\n0.114881 0.114881 0.385119 Na\n0.385119 0.385119 0.114881 Na\n0.135119 0.135119 0.864881 Na\n0.864881 0.864881 0.135119 Na\n0.822226 0.564121 0.565044 H\n0.048609 0.565044 0.564121 H\n0.565044 0.048609 0.822226 H\n0.564121 0.822226 0.048609 H\n0.427774 0.685879 0.684956 H\n0.685879 0.427774 0.201391 H\n0.684956 0.201391 0.427774 H\n0.201391 0.684956 0.685879 H\n0.764712 0.235288 0.235288 N\n0.485288 0.014712 0.014712 N\n0.235288 0.764712 0.764712 N\n0.014712 0.485288 0.485288 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Na",
"H",
"N"
],
"chemical_system": "H-N-Na",
"density": 1.3082142195941655,
"density_atomic": 0.08077698803328431,
"volume": 198.0762143966939,
"volume_molar": 7.455267776905182,
"formula_full": "Na4 H8 N4",
"formula_reduced": "NaH2N",
"formula_anonymous": "ABC2",
"energy": -72.89236371,
"energy_per_atom": -4.555772731875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -71.44836371,
"band_gap": 1.9459,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6.31e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:11.330000Z",
"spacegroup": 70
},
{
"id": "mp-25932",
"created_at": "2022-09-04T14:45:26.965797Z",
"structure_string": "Mn8 P6 O24\n1.0\n-3.386783 3.386783 9.794688\n3.386783 -3.386783 9.794688\n3.386783 3.386783 -9.794688\nMn P O\n8 6 24\ndirect\n0.769476 0.769476 0.000000 Mn\n0.126344 0.125000 0.501344 Mn\n0.375000 0.873656 0.998656 Mn\n0.230524 0.230524 0.000000 Mn\n0.875000 0.376344 0.001344 Mn\n0.980524 0.480524 0.500000 Mn\n0.519476 0.019476 0.500000 Mn\n0.623656 0.625000 0.498656 Mn\n0.000000 0.000000 0.000000 P\n0.750000 0.250000 0.500000 P\n0.530525 0.125000 0.905525 P\n0.875000 0.780525 0.405525 P\n0.219475 0.625000 0.094475 P\n0.375000 0.469475 0.594475 P\n0.073924 0.784876 0.151994 O\n0.440816 0.135594 0.707544 O\n0.864406 0.571950 0.305222 O\n0.117117 0.465124 0.789048 O\n0.266728 0.559184 0.694778 O\n0.885594 0.690816 0.207544 O\n0.226577 0.975938 0.119303 O\n0.893366 0.274062 0.750639 O\n0.215124 0.367117 0.289048 O\n0.671930 0.882883 0.348006 O\n0.024062 0.143366 0.250639 O\n0.857274 0.106634 0.380697 O\n0.676076 0.328070 0.210952 O\n0.309184 0.516728 0.194778 O\n0.892726 0.773423 0.749361 O\n0.725938 0.476577 0.619303 O\n0.078070 0.926076 0.710952 O\n0.534876 0.323924 0.651994 O\n0.321950 0.114406 0.805222 O\n0.632883 0.921930 0.848006 O\n0.483272 0.678050 0.792456 O\n0.428050 0.733272 0.292456 O\n0.856634 0.107274 0.880697 O\n0.523423 0.142726 0.249361 O\n",
"nsites": 38,
"nelements": 3,
"elements": [
"Mn",
"P",
"O"
],
"chemical_system": "Mn-O-P",
"density": 3.7295636949047783,
"density_atomic": 0.0845586919981323,
"volume": 449.3920033772439,
"volume_molar": 7.121847107253047,
"formula_full": "Mn8 P6 O24",
"formula_reduced": "Mn4(PO4)3",
"formula_anonymous": "A3B4C12",
"energy": -318.96146799,
"energy_per_atom": -8.393722841842106,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -289.12946799,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 38.0029761,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:03.859000Z",
"spacegroup": 122
},
{
"id": "mp-801976",
"created_at": "2022-09-04T14:45:26.971435Z",
"structure_string": "Li3 V3 O5 F3\n1.0\n5.881415 0.000000 0.000000\n-2.878355 -5.231043 0.000000\n0.022115 3.363214 -5.001864\nLi V O F\n3 3 5 3\ndirect\n0.011599 0.986532 0.023556 Li\n0.747262 0.012934 0.232719 Li\n0.370734 0.500649 0.624079 Li\n0.357212 0.003398 0.604895 V\n0.363910 0.480179 0.131490 V\n0.876802 0.003583 0.624351 V\n0.154527 0.013459 0.381231 O\n0.606867 0.463583 0.369518 O\n0.609721 0.589814 0.829667 O\n0.153830 0.416871 0.428262 O\n0.142457 0.548491 0.868744 O\n0.627951 0.999321 0.383992 F\n0.123592 0.991835 0.872308 F\n0.603535 0.989353 0.875187 F\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.352000502018035,
"density_atomic": 0.09097583318371373,
"volume": 153.88702153162853,
"volume_molar": 6.619495034290127,
"formula_full": "Li3 V3 O5 F3",
"formula_reduced": "Li3V3O5F3",
"formula_anonymous": "A3B3C3D5",
"energy": -74.97620247,
"energy_per_atom": -5.3554430335714285,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.05520247,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.0000154,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:00.942000Z",
"spacegroup": 1
},
{
"id": "mp-723393",
"created_at": "2022-09-04T14:45:26.981011Z",
"structure_string": "Te1 N2 Cl6\n1.0\n0.000000 5.251431 5.251431\n5.251431 0.000000 5.251431\n5.251431 5.251431 0.000000\nTe N Cl\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Te\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n0.774054 0.774054 0.225946 Cl\n0.225946 0.774054 0.225946 Cl\n0.774054 0.225946 0.225946 Cl\n0.225946 0.225946 0.774054 Cl\n0.774054 0.225946 0.774054 Cl\n0.225946 0.774054 0.774054 Cl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Te",
"N",
"Cl"
],
"chemical_system": "Cl-N-Te",
"density": 2.111664188902468,
"density_atomic": 0.031072737999081456,
"volume": 289.6429661353322,
"volume_molar": 19.380785691232038,
"formula_full": "Te1 N2 Cl6",
"formula_reduced": "Te(NCl3)2",
"formula_anonymous": "AB2C6",
"energy": -26.70451961,
"energy_per_atom": -2.9671688455555554,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.02051961,
"band_gap": 0.7061999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.000154,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:59.211000Z",
"spacegroup": 225
},
{
"id": "mp-759640",
"created_at": "2022-09-04T14:45:26.966470Z",
"structure_string": "Li4 Cu4 C4 O12\n1.0\n3.214614 0.000000 0.000000\n0.000000 4.809137 0.000000\n0.000000 0.961503 17.108748\nLi Cu C O\n4 4 4 12\ndirect\n0.202193 0.846059 0.082849 Li\n0.246574 0.190533 0.457418 Li\n0.797807 0.846059 0.582849 Li\n0.753426 0.190533 0.957418 Li\n0.060295 0.286809 0.277293 Cu\n0.559314 0.689564 0.234775 Cu\n0.939705 0.286809 0.777293 Cu\n0.440686 0.689564 0.734775 Cu\n0.717312 0.307434 0.122981 C\n0.186894 0.712287 0.382947 C\n0.282688 0.307434 0.622981 C\n0.813106 0.712287 0.882947 C\n0.596283 0.185260 0.062017 O\n0.910985 0.158401 0.177661 O\n0.651235 0.575733 0.129213 O\n0.121722 0.444748 0.375881 O\n0.344418 0.863287 0.323550 O\n0.099548 0.820398 0.447194 O\n0.403717 0.185260 0.562017 O\n0.089015 0.158401 0.677661 O\n0.348765 0.575733 0.629213 O\n0.878278 0.444748 0.875881 O\n0.655582 0.863287 0.823550 O\n0.900452 0.820398 0.947194 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Cu",
"C",
"O"
],
"chemical_system": "C-Cu-Li-O",
"density": 3.277115478787822,
"density_atomic": 0.09073963568290713,
"volume": 264.49301696415057,
"volume_molar": 6.6367257424799275,
"formula_full": "Li4 Cu4 C4 O12",
"formula_reduced": "LiCuCO3",
"formula_anonymous": "ABCD3",
"energy": -160.01259709,
"energy_per_atom": -6.667191545416667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -151.76859709,
"band_gap": 1.5463,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002358,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:00.560000Z",
"spacegroup": 7
}
]
}