GET /third-parties/MatprojStructure/?format=api&ordering=-energy_above_hull&page=12186
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=-energy_above_hull&page=12187",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-energy_above_hull&page=12185",
    "results": [
        {
            "id": "mp-1074803",
            "created_at": "2022-09-04T14:42:59.572193Z",
            "structure_string": "Mg14 Si8\n1.0\n5.442614 0.000000 0.000000\n0.152086 6.219227 0.000000\n1.104259 0.657766 13.113525\nMg Si\n14 8\ndirect\n0.903945 0.846900 0.193526 Mg\n0.700586 0.347523 0.239974 Mg\n0.105430 0.149114 0.377454 Mg\n0.254034 0.621949 0.356122 Mg\n0.979256 0.436514 0.004953 Mg\n0.492181 0.241611 0.537975 Mg\n0.898085 0.675421 0.772131 Mg\n0.473824 0.720071 0.593049 Mg\n0.447037 0.661654 0.081812 Mg\n0.510834 0.167583 0.030967 Mg\n0.017595 0.940151 0.957244 Mg\n0.769353 0.192740 0.768163 Mg\n0.965155 0.945649 0.573103 Mg\n0.984604 0.454739 0.565195 Mg\n0.510285 0.873283 0.885073 Si\n0.401950 0.969770 0.223422 Si\n0.209114 0.324928 0.190081 Si\n0.278945 0.380109 0.731494 Si\n0.478674 0.488055 0.880229 Si\n0.624003 0.975733 0.385551 Si\n0.736265 0.601333 0.403101 Si\n0.262435 0.992565 0.745693 Si\n",
            "nsites": 22,
            "nelements": 2,
            "elements": [
                "Mg",
                "Si"
            ],
            "chemical_system": "Mg-Si",
            "density": 2.11348316905945,
            "density_atomic": 0.04956319437193766,
            "volume": 443.87776612833187,
            "volume_molar": 12.150429035723523,
            "formula_full": "Mg14 Si8",
            "formula_reduced": "Mg7Si4",
            "formula_anonymous": "A4B7",
            "energy": -64.34136961,
            "energy_per_atom": -2.924607709545455,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -64.90936961,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0014574,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:01.647000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1215528",
            "created_at": "2022-09-04T14:42:59.576941Z",
            "structure_string": "Zr2 Co3 Mo1\n1.0\n4.242713 -2.553813 0.000000\n4.242713 2.553813 0.000000\n2.705498 0.000000 4.147633\nZr Co Mo\n2 3 1\ndirect\n0.627757 0.627757 0.627757 Zr\n0.372243 0.372243 0.372243 Zr\n0.000000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Mo\n",
            "nsites": 6,
            "nelements": 3,
            "elements": [
                "Zr",
                "Co",
                "Mo"
            ],
            "chemical_system": "Co-Mo-Zr",
            "density": 8.409621332273778,
            "density_atomic": 0.06675567403986145,
            "volume": 89.88000025911285,
            "volume_molar": 9.0211668844869,
            "formula_full": "Zr2 Co3 Mo1",
            "formula_reduced": "Zr2Co3Mo",
            "formula_anonymous": "AB2C3",
            "energy": -50.734140620000005,
            "energy_per_atom": -8.455690103333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -50.734140620000005,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.1230281,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:00.560000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-768600",
            "created_at": "2022-09-04T14:42:59.576828Z",
            "structure_string": "Al2 Ni4 O8\n1.0\n0.000000 4.103844 4.103844\n4.103844 0.000000 4.103844\n4.103844 4.103844 0.000000\nAl Ni O\n2 4 8\ndirect\n0.750000 0.750000 0.750000 Al\n0.500000 0.500000 0.500000 Al\n0.125000 0.625000 0.125000 Ni\n0.125000 0.125000 0.625000 Ni\n0.625000 0.125000 0.125000 Ni\n0.125000 0.125000 0.125000 Ni\n0.368593 0.877136 0.877136 O\n0.877136 0.877136 0.877136 O\n0.372864 0.881407 0.372864 O\n0.372864 0.372864 0.881407 O\n0.877136 0.877136 0.368593 O\n0.877136 0.368593 0.877136 O\n0.881407 0.372864 0.372864 O\n0.372864 0.372864 0.372864 O\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Al",
                "Ni",
                "O"
            ],
            "chemical_system": "Al-Ni-O",
            "density": 5.006143490589229,
            "density_atomic": 0.10128042368462777,
            "volume": 138.23006945146602,
            "volume_molar": 5.946006682152174,
            "formula_full": "Al2 Ni4 O8",
            "formula_reduced": "Al(NiO2)2",
            "formula_anonymous": "AB2C4",
            "energy": -96.95876869,
            "energy_per_atom": -6.925626335,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -81.29876869,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 6.0023379,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:14.341000Z",
            "spacegroup": 227
        },
        {
            "id": "mp-704630",
            "created_at": "2022-09-04T14:42:59.578120Z",
            "structure_string": "Be6 Fe8 Si6 Te2 O24\n1.0\n8.445122 0.000000 0.000000\n0.000000 8.445122 0.000000\n0.000000 0.000000 8.445122\nBe Fe Si Te O\n6 8 6 2 24\ndirect\n0.500000 0.250000 0.000000 Be\n0.750000 0.000000 0.500000 Be\n0.000000 0.500000 0.250000 Be\n0.000000 0.500000 0.750000 Be\n0.500000 0.750000 0.000000 Be\n0.250000 0.000000 0.500000 Be\n0.314508 0.314508 0.685492 Fe\n0.185492 0.814508 0.814508 Fe\n0.685492 0.314508 0.314508 Fe\n0.314508 0.685492 0.314508 Fe\n0.814508 0.185492 0.814508 Fe\n0.185492 0.185492 0.185492 Fe\n0.685492 0.685492 0.685492 Fe\n0.814508 0.814508 0.185492 Fe\n0.500000 0.000000 0.750000 Si\n0.000000 0.750000 0.500000 Si\n0.000000 0.250000 0.500000 Si\n0.500000 0.000000 0.250000 Si\n0.250000 0.500000 0.000000 Si\n0.750000 0.500000 0.000000 Si\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.500000 Te\n0.922615 0.358725 0.355929 O\n0.855929 0.858725 0.422615 O\n0.644071 0.922615 0.641275 O\n0.144071 0.141275 0.422615 O\n0.641275 0.355929 0.077385 O\n0.358725 0.644071 0.077385 O\n0.422615 0.144071 0.141275 O\n0.355929 0.922615 0.358725 O\n0.858725 0.577385 0.144071 O\n0.358725 0.355929 0.922615 O\n0.644071 0.077385 0.358725 O\n0.141275 0.422615 0.144071 O\n0.577385 0.855929 0.141275 O\n0.922615 0.641275 0.644071 O\n0.077385 0.641275 0.355929 O\n0.858725 0.422615 0.855929 O\n0.577385 0.144071 0.858725 O\n0.641275 0.644071 0.922615 O\n0.144071 0.858725 0.577385 O\n0.355929 0.077385 0.641275 O\n0.422615 0.855929 0.858725 O\n0.855929 0.141275 0.577385 O\n0.141275 0.577385 0.855929 O\n0.077385 0.358725 0.644071 O\n",
            "nsites": 46,
            "nelements": 5,
            "elements": [
                "Be",
                "Fe",
                "Si",
                "Te",
                "O"
            ],
            "chemical_system": "Be-Fe-O-Si-Te",
            "density": 3.6075765842787555,
            "density_atomic": 0.0763730347635834,
            "volume": 602.3068238992379,
            "volume_molar": 7.885166248325527,
            "formula_full": "Be6 Fe8 Si6 Te2 O24",
            "formula_reduced": "Be3Fe4Si3TeO12",
            "formula_anonymous": "AB3C3D4E12",
            "energy": -355.54128946,
            "energy_per_atom": -7.7291584665217385,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -320.16128946,
            "band_gap": 3.246900000000001,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 32.0021079,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:56.860000Z",
            "spacegroup": 218
        },
        {
            "id": "mp-1518242",
            "created_at": "2022-09-04T14:42:59.603488Z",
            "structure_string": "Nb1 Ga1 Sn2 O6\n1.0\n0.000000 -4.003931 -4.003931\n4.003931 0.000000 -4.003931\n4.003931 -4.003931 0.000000\nNb Ga Sn O\n1 1 2 6\ndirect\n0.500000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Ga\n0.250000 0.250000 0.250000 Sn\n0.750000 0.750000 0.750000 Sn\n0.751069 0.248931 0.248931 O\n0.248931 0.751069 0.751069 O\n0.751069 0.248931 0.751069 O\n0.248931 0.751069 0.248931 O\n0.751069 0.751069 0.248931 O\n0.248931 0.248931 0.751069 O\n",
            "nsites": 10,
            "nelements": 4,
            "elements": [
                "Nb",
                "Ga",
                "Sn",
                "O"
            ],
            "chemical_system": "Ga-Nb-O-Sn",
            "density": 6.4162474871181905,
            "density_atomic": 0.0778951199459353,
            "volume": 128.3777469877536,
            "volume_molar": 7.73108862811918,
            "formula_full": "Nb1 Ga1 Sn2 O6",
            "formula_reduced": "NbGa(SnO3)2",
            "formula_anonymous": "ABC2D6",
            "energy": -71.85411163,
            "energy_per_atom": -7.185411163,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -67.73211163,
            "band_gap": 1.9471,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:01.733000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1179359",
            "created_at": "2022-09-04T14:42:59.614693Z",
            "structure_string": "Sr4 C8 O16\n1.0\n5.040997 0.000000 0.000000\n0.000000 6.837141 0.000000\n0.000000 0.000000 11.539241\nSr C O\n4 8 16\ndirect\n0.492053 0.005479 0.570424 Sr\n0.992053 0.494521 0.429576 Sr\n0.507947 0.505479 0.929576 Sr\n0.007947 0.994521 0.070424 Sr\n0.171593 0.616155 0.694561 C\n0.671593 0.883845 0.305439 C\n0.828407 0.116155 0.805439 C\n0.328407 0.383845 0.194561 C\n0.678855 0.920174 0.830383 C\n0.178855 0.579826 0.169617 C\n0.321145 0.420174 0.669617 C\n0.821145 0.079826 0.330383 C\n0.118588 0.720283 0.604931 O\n0.618588 0.779717 0.395069 O\n0.881412 0.220283 0.895069 O\n0.381412 0.279717 0.104931 O\n0.121566 0.652695 0.798735 O\n0.621566 0.847305 0.201265 O\n0.878434 0.152695 0.701265 O\n0.378434 0.347305 0.298735 O\n0.606809 0.818391 0.745090 O\n0.106809 0.681609 0.254910 O\n0.393191 0.318391 0.754910 O\n0.893191 0.181609 0.245090 O\n0.637134 0.873125 0.936428 O\n0.137134 0.626875 0.063572 O\n0.362866 0.373125 0.563572 O\n0.862866 0.126875 0.436428 O\n",
            "nsites": 28,
            "nelements": 3,
            "elements": [
                "Sr",
                "C",
                "O"
            ],
            "chemical_system": "C-O-Sr",
            "density": 2.933336089550532,
            "density_atomic": 0.07040278061043466,
            "volume": 397.71156419140095,
            "volume_molar": 8.553839362287116,
            "formula_full": "Sr4 C8 O16",
            "formula_reduced": "Sr(CO2)2",
            "formula_anonymous": "AB2C4",
            "energy": -219.92112953,
            "energy_per_atom": -7.854326054642857,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -208.92912953,
            "band_gap": 3.0794,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0024601,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:04.406000Z",
            "spacegroup": 19
        },
        {
            "id": "mp-1349386",
            "created_at": "2022-09-04T14:42:59.541531Z",
            "structure_string": "Li8 Fe4 Co12 O32\n1.0\n5.735508 5.742934 0.000000\n-5.735508 5.742934 0.000000\n0.000000 0.024021 8.084109\nLi Fe Co O\n8 4 12 32\ndirect\n0.998837 0.749969 0.876609 Li\n0.250031 0.001163 0.123391 Li\n0.749284 0.998297 0.622000 Li\n0.001703 0.250716 0.378000 Li\n0.501772 0.248401 0.878438 Li\n0.247862 0.499751 0.622761 Li\n0.751599 0.498228 0.121562 Li\n0.500249 0.752138 0.377239 Li\n0.875338 0.875814 0.250097 Fe\n0.124186 0.124662 0.749903 Fe\n0.624299 0.375701 0.500000 Fe\n0.375430 0.624570 0.000000 Fe\n0.126181 0.873819 0.500000 Co\n0.376864 0.875082 0.747624 Co\n0.623609 0.876040 0.999680 Co\n0.372994 0.122056 0.497552 Co\n0.622384 0.123017 0.247466 Co\n0.874376 0.125624 0.000000 Co\n0.371812 0.371365 0.249929 Co\n0.123960 0.376391 0.000320 Co\n0.876983 0.377616 0.752534 Co\n0.124918 0.623136 0.252376 Co\n0.877944 0.627006 0.502448 Co\n0.628635 0.628188 0.750071 Co\n0.111975 0.858213 0.261992 O\n0.889290 0.862533 0.481883 O\n0.609949 0.863085 0.762122 O\n0.141787 0.888025 0.738008 O\n0.385120 0.862007 0.982926 O\n0.363232 0.887532 0.515082 O\n0.638330 0.891580 0.238558 O\n0.861551 0.888089 0.017555 O\n0.137467 0.110710 0.518117 O\n0.363182 0.109013 0.736361 O\n0.638923 0.111446 0.015571 O\n0.609574 0.130793 0.478149 O\n0.859277 0.111381 0.238432 O\n0.385299 0.136546 0.261090 O\n0.111911 0.138449 0.982445 O\n0.888619 0.140723 0.761568 O\n0.377676 0.357738 0.478858 O\n0.603463 0.354978 0.248047 O\n0.888554 0.361077 0.984429 O\n0.362155 0.387884 0.016395 O\n0.108420 0.361670 0.761442 O\n0.136915 0.390051 0.237878 O\n0.869207 0.390426 0.521851 O\n0.645022 0.396537 0.751953 O\n0.359967 0.609134 0.241199 O\n0.137993 0.614880 0.017074 O\n0.863454 0.614701 0.738910 O\n0.890987 0.636818 0.263639 O\n0.642262 0.622324 0.521142 O\n0.112468 0.636768 0.484918 O\n0.390866 0.640033 0.758801 O\n0.612116 0.637845 0.983605 O\n",
            "nsites": 56,
            "nelements": 4,
            "elements": [
                "Li",
                "Fe",
                "Co",
                "O"
            ],
            "chemical_system": "Co-Fe-Li-O",
            "density": 4.671090719962162,
            "density_atomic": 0.10515263393633618,
            "volume": 532.5591752072016,
            "volume_molar": 5.727046993084411,
            "formula_full": "Li8 Fe4 Co12 O32",
            "formula_reduced": "Li2FeCo3O8",
            "formula_anonymous": "AB2C3D8",
            "energy": -378.41667289,
            "energy_per_atom": -6.757440587321428,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -327.75267289,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 15.9378344,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:02.475000Z",
            "spacegroup": 155
        },
        {
            "id": "mp-1113564",
            "created_at": "2022-09-04T14:42:59.563921Z",
            "structure_string": "Rb2 Hg1 As1 Br6\n1.0\n0.000000 5.627349 5.627349\n5.627349 0.000000 5.627349\n5.627349 5.627349 0.000000\nRb Hg As Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 As\n0.761675 0.238325 0.238325 Br\n0.238325 0.238325 0.761675 Br\n0.238325 0.761675 0.761675 Br\n0.238325 0.761675 0.238325 Br\n0.761675 0.238325 0.761675 Br\n0.761675 0.761675 0.238325 Br\n",
            "nsites": 10,
            "nelements": 4,
            "elements": [
                "Rb",
                "Hg",
                "As",
                "Br"
            ],
            "chemical_system": "As-Br-Hg-Rb",
            "density": 4.313781326210396,
            "density_atomic": 0.028058112579023943,
            "volume": 356.4031604704563,
            "volume_molar": 21.463099996619558,
            "formula_full": "Rb2 Hg1 As1 Br6",
            "formula_reduced": "Rb2HgAsBr6",
            "formula_anonymous": "ABC2D6",
            "energy": -29.40293499,
            "energy_per_atom": -2.940293499,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -26.19893499,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0490255,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:04.109000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1195604",
            "created_at": "2022-09-04T14:42:59.567182Z",
            "structure_string": "Mg1 H30 C2 S2 O18\n1.0\n7.645262 -4.709427 0.000000\n7.645262 4.709427 0.000000\n4.744289 0.000000 7.623677\nMg H C S O\n1 30 2 2 18\ndirect\n0.000000 0.000000 0.000000 Mg\n0.123486 0.076688 0.642750 H\n0.642750 0.123486 0.076688 H\n0.076688 0.642750 0.123486 H\n0.876514 0.923312 0.357250 H\n0.357250 0.876514 0.923312 H\n0.923312 0.357250 0.876514 H\n0.118006 0.880297 0.719285 H\n0.719285 0.118006 0.880297 H\n0.880297 0.719285 0.118006 H\n0.881994 0.119703 0.280715 H\n0.280715 0.881994 0.119703 H\n0.119703 0.280715 0.881994 H\n0.275642 0.495607 0.404416 H\n0.404416 0.275642 0.495607 H\n0.495607 0.404416 0.275642 H\n0.724358 0.504393 0.595584 H\n0.595584 0.724358 0.504393 H\n0.504393 0.595584 0.724358 H\n0.057845 0.718756 0.613997 H\n0.613997 0.057845 0.718756 H\n0.718756 0.613997 0.057845 H\n0.942155 0.281244 0.386003 H\n0.386003 0.942155 0.281244 H\n0.281244 0.386003 0.942155 H\n0.211660 0.593218 0.697815 H\n0.697815 0.211660 0.593218 H\n0.593218 0.697815 0.211660 H\n0.788340 0.406782 0.302185 H\n0.302185 0.788340 0.406782 H\n0.406782 0.302185 0.788340 H\n0.375917 0.375917 0.375917 C\n0.624083 0.624083 0.624083 C\n0.293002 0.293002 0.293002 S\n0.706998 0.706998 0.706998 S\n0.106903 0.977335 0.751153 O\n0.751153 0.106903 0.977335 O\n0.977335 0.751153 0.106903 O\n0.893097 0.022665 0.248847 O\n0.248847 0.893097 0.022665 O\n0.022665 0.248847 0.893097 O\n0.131545 0.256789 0.431413 O\n0.431413 0.131545 0.256789 O\n0.256789 0.431413 0.131545 O\n0.868455 0.743211 0.568587 O\n0.568587 0.868455 0.743211 O\n0.743211 0.568587 0.868455 O\n0.164471 0.715368 0.624589 O\n0.624589 0.164471 0.715368 O\n0.715368 0.624589 0.164471 O\n0.835529 0.284632 0.375411 O\n0.375411 0.835529 0.284632 O\n0.284632 0.375411 0.835529 O\n",
            "nsites": 53,
            "nelements": 5,
            "elements": [
                "Mg",
                "H",
                "C",
                "S",
                "O"
            ],
            "chemical_system": "C-H-Mg-O-S",
            "density": 1.302724880600274,
            "density_atomic": 0.09654303414192252,
            "volume": 548.9779813848368,
            "volume_molar": 6.237778637811597,
            "formula_full": "Mg1 H30 C2 S2 O18",
            "formula_reduced": "MgH30C2(SO9)2",
            "formula_anonymous": "AB2C2D18E30",
            "energy": -286.43408151,
            "energy_per_atom": -5.404416632264151,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -274.06808151,
            "band_gap": 5.1717,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0027173,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:01.046000Z",
            "spacegroup": 148
        },
        {
            "id": "mp-1235038",
            "created_at": "2022-09-04T14:42:59.570491Z",
            "structure_string": "Ba3 Li1 As2 O8\n1.0\n5.618398 0.091003 6.150998\n2.447118 5.058290 6.150998\n0.142541 0.091003 8.329517\nBa Li As O\n3 1 2 8\ndirect\n0.791877 0.791877 0.791877 Ba\n0.208123 0.208123 0.208123 Ba\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Li\n0.602465 0.602465 0.602465 As\n0.397535 0.397535 0.397535 As\n0.679354 0.679354 0.679354 O\n0.320646 0.320646 0.320646 O\n0.721547 0.721547 0.254494 O\n0.721547 0.254494 0.721547 O\n0.254494 0.721547 0.721547 O\n0.278453 0.745506 0.278453 O\n0.278453 0.278453 0.745506 O\n0.745506 0.278453 0.278453 O\n",
            "nsites": 14,
            "nelements": 4,
            "elements": [
                "Ba",
                "Li",
                "As",
                "O"
            ],
            "chemical_system": "As-Ba-Li-O",
            "density": 5.058238459356459,
            "density_atomic": 0.06120610989743927,
            "volume": 228.73533415960046,
            "volume_molar": 9.839116993533931,
            "formula_full": "Ba3 Li1 As2 O8",
            "formula_reduced": "Ba3Li(AsO4)2",
            "formula_anonymous": "AB2C3D8",
            "energy": -90.36832769,
            "energy_per_atom": -6.454880549285714,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -84.87232769,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0013626,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:08.376000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1034891",
            "created_at": "2022-09-04T14:42:59.579258Z",
            "structure_string": "La1 Hf1 Mg14 O16\n1.0\n8.860523 0.000000 -0.000000\n0.000000 8.907931 0.000000\n0.000000 0.000000 4.450809\nLa Hf Mg O\n1 1 14 16\ndirect\n0.000000 0.000000 -0.000000 La\n0.000000 0.500000 -0.000000 Hf\n0.500000 0.000000 -0.000000 Mg\n0.500000 0.500000 -0.000000 Mg\n0.000000 0.259035 0.500000 Mg\n0.000000 0.740965 0.500000 Mg\n0.500000 0.252481 0.500000 Mg\n0.500000 0.747519 0.500000 Mg\n0.269163 0.000000 0.500000 Mg\n0.259740 0.500000 0.500000 Mg\n0.730837 0.000000 0.500000 Mg\n0.740260 0.500000 0.500000 Mg\n0.264439 0.254192 0.000000 Mg\n0.264439 0.745808 0.000000 Mg\n0.735561 0.254192 -0.000000 Mg\n0.735561 0.745808 -0.000000 Mg\n0.272760 0.000000 -0.000000 O\n0.257628 0.500000 0.000000 O\n0.727240 0.000000 0.000000 O\n0.742372 0.500000 -0.000000 O\n0.251327 0.249501 0.500000 O\n0.251327 0.750499 0.500000 O\n0.748673 0.249501 0.500000 O\n0.748673 0.750499 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.264429 -0.000000 O\n0.000000 0.735571 -0.000000 O\n0.500000 0.254714 -0.000000 O\n0.500000 0.745286 0.000000 O\n",
            "nsites": 32,
            "nelements": 4,
            "elements": [
                "La",
                "Hf",
                "Mg",
                "O"
            ],
            "chemical_system": "Hf-La-Mg-O",
            "density": 4.318735305897287,
            "density_atomic": 0.09109086352622614,
            "volume": 351.29758091256673,
            "volume_molar": 6.611135877821769,
            "formula_full": "La1 Hf1 Mg14 O16",
            "formula_reduced": "LaHfMg14O16",
            "formula_anonymous": "ABC14D16",
            "energy": -206.58361141,
            "energy_per_atom": -6.4557378565625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -195.59161141,
            "band_gap": 0.4869000000000003,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 1.4304728,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:05.225000Z",
            "spacegroup": 47
        },
        {
            "id": "mp-1046151",
            "created_at": "2022-09-04T14:42:59.584223Z",
            "structure_string": "Sr2 Mg2 Sn2 P4 O16\n1.0\n5.611404 0.000000 0.000000\n-0.851241 7.102741 0.000000\n-2.567236 -3.351173 9.127332\nSr Mg Sn P O\n2 2 2 4 16\ndirect\n0.801649 0.248893 0.037529 Sr\n0.198351 0.751107 0.962471 Sr\n0.620977 0.278301 0.638422 Mg\n0.379023 0.721699 0.361578 Mg\n0.964109 0.752861 0.583463 Sn\n0.035891 0.247139 0.416537 Sn\n0.845843 0.799954 0.213459 P\n0.154157 0.200046 0.786541 P\n0.463824 0.267243 0.281606 P\n0.536176 0.732757 0.718394 P\n0.120175 0.358789 0.918161 O\n0.582001 0.750887 0.232168 O\n0.121005 0.987181 0.802837 O\n0.720579 0.581196 0.699377 O\n0.417999 0.249113 0.767832 O\n0.510871 0.810933 0.585606 O\n0.489129 0.189067 0.414394 O\n0.643718 0.894409 0.868171 O\n0.878995 0.012819 0.197163 O\n0.356282 0.105591 0.131829 O\n0.879825 0.641211 0.081839 O\n0.065523 0.824776 0.354009 O\n0.934477 0.175224 0.645991 O\n0.730116 0.382717 0.298024 O\n0.279421 0.418804 0.300623 O\n0.269884 0.617283 0.701976 O\n",
            "nsites": 26,
            "nelements": 5,
            "elements": [
                "Sr",
                "Mg",
                "Sn",
                "P",
                "O"
            ],
            "chemical_system": "Mg-O-P-Sn-Sr",
            "density": 3.8395824304243154,
            "density_atomic": 0.07147134978246591,
            "volume": 363.78213198904194,
            "volume_molar": 8.425950787734267,
            "formula_full": "Sr2 Mg2 Sn2 P4 O16",
            "formula_reduced": "SrMgSn(PO4)2",
            "formula_anonymous": "ABCD2E8",
            "energy": -188.82849566,
            "energy_per_atom": -7.262634448461538,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -177.83649566,
            "band_gap": 3.4052,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0015678,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:03.269000Z",
            "spacegroup": 2
        }
    ]
}