GET /third-parties/MatprojStructure/?format=api&ordering=nelements&page=142
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=nelements&page=143",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=nelements&page=141",
    "results": [
        {
            "id": "mp-1075422",
            "created_at": "2022-09-04T14:41:52.252171Z",
            "structure_string": "Mg10 Si12\n1.0\n4.736973 0.000000 0.000000\n2.223808 5.208041 0.000000\n2.204529 0.070934 16.503923\nMg Si\n10 12\ndirect\n0.079288 0.615640 0.050750 Mg\n0.914713 0.427411 0.356503 Mg\n0.421750 0.225805 0.684395 Mg\n0.359347 0.883893 0.343276 Mg\n0.907012 0.860659 0.227234 Mg\n0.236282 0.433026 0.862601 Mg\n0.204813 0.683076 0.552602 Mg\n0.919871 0.265621 0.538008 Mg\n0.759663 0.213752 0.086202 Mg\n0.555110 0.837348 0.819718 Mg\n0.384746 0.010198 0.979673 Si\n0.657671 0.542745 0.959578 Si\n0.817855 0.928291 0.412825 Si\n0.564541 0.949908 0.550496 Si\n0.874390 0.090731 0.920639 Si\n0.418944 0.891288 0.131069 Si\n0.559492 0.493676 0.226212 Si\n0.725606 0.601892 0.669191 Si\n0.145756 0.731994 0.719918 Si\n0.410492 0.346436 0.431255 Si\n0.170691 0.306686 0.201589 Si\n0.908495 0.163715 0.772763 Si\n",
            "nsites": 22,
            "nelements": 2,
            "elements": [
                "Mg",
                "Si"
            ],
            "chemical_system": "Mg-Si",
            "density": 2.3657644545014542,
            "density_atomic": 0.05403313776273937,
            "volume": 407.15755017971486,
            "volume_molar": 11.145273084904574,
            "formula_full": "Mg10 Si12",
            "formula_reduced": "Mg5Si6",
            "formula_anonymous": "A5B6",
            "energy": -77.87878814999999,
            "energy_per_atom": -3.5399449159090906,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -78.73078815,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004557,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:30.811000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-23207",
            "created_at": "2022-09-04T14:41:52.371843Z",
            "structure_string": "Cl8 O16\n1.0\n5.674172 0.000000 0.000000\n0.000000 7.076304 0.000000\n0.000000 0.000000 10.938480\nCl O\n8 16\ndirect\n0.827415 0.007417 0.608275 Cl\n0.327415 0.992583 0.891725 Cl\n0.672585 0.507417 0.391725 Cl\n0.172585 0.492583 0.108275 Cl\n0.172585 0.992583 0.391725 Cl\n0.672585 0.007417 0.108275 Cl\n0.327415 0.492583 0.608275 Cl\n0.827415 0.507417 0.891725 Cl\n0.792076 0.094220 0.484300 O\n0.292076 0.905780 0.015700 O\n0.707924 0.594220 0.515700 O\n0.207924 0.405780 0.984300 O\n0.207924 0.905780 0.515700 O\n0.707924 0.094220 0.984300 O\n0.292076 0.405780 0.484300 O\n0.792076 0.594220 0.015700 O\n0.903435 0.639000 0.793787 O\n0.403435 0.361000 0.706213 O\n0.596565 0.139000 0.206213 O\n0.096565 0.861000 0.293787 O\n0.096565 0.361000 0.206213 O\n0.596565 0.639000 0.293787 O\n0.403435 0.861000 0.793787 O\n0.903435 0.139000 0.706213 O\n",
            "nsites": 24,
            "nelements": 2,
            "elements": [
                "Cl",
                "O"
            ],
            "chemical_system": "Cl-O",
            "density": 2.0401714820889305,
            "density_atomic": 0.05464435275525579,
            "volume": 439.20366496959997,
            "volume_molar": 11.02060955314505,
            "formula_full": "Cl8 O16",
            "formula_reduced": "ClO2",
            "formula_anonymous": "AB2",
            "energy": -102.42459571,
            "energy_per_atom": -4.267691487916667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -91.43259571,
            "band_gap": 0.9646,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0030433,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:33.360000Z",
            "spacegroup": 61
        },
        {
            "id": "mp-2373",
            "created_at": "2022-09-04T14:41:47.500045Z",
            "structure_string": "Pr2 Fe4\n1.0\n0.000000 3.741343 3.741343\n3.741343 0.000000 3.741343\n3.741343 3.741343 0.000000\nPr Fe\n2 4\ndirect\n0.500000 0.500000 0.500000 Pr\n0.750000 0.750000 0.750000 Pr\n0.125000 0.125000 0.125000 Fe\n0.625000 0.125000 0.125000 Fe\n0.125000 0.625000 0.125000 Fe\n0.125000 0.125000 0.625000 Fe\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "Pr",
                "Fe"
            ],
            "chemical_system": "Fe-Pr",
            "density": 8.00932334763476,
            "density_atomic": 0.05728470467775056,
            "volume": 104.74000055952817,
            "volume_molar": 10.512650442865956,
            "formula_full": "Pr2 Fe4",
            "formula_reduced": "PrFe2",
            "formula_anonymous": "AB2",
            "energy": -42.73644691,
            "energy_per_atom": -7.122741151666666,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -42.73644691,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 7.7778859,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:24.538000Z",
            "spacegroup": 227
        },
        {
            "id": "mp-570781",
            "created_at": "2022-09-04T14:41:47.511746Z",
            "structure_string": "Cd6 I12\n1.0\n2.166899 -3.753179 0.000000\n2.166899 3.753179 0.000000\n0.000000 0.000000 45.351689\nCd I\n6 12\ndirect\n0.333333 0.666667 0.541562 Cd\n0.333333 0.666667 0.374948 Cd\n0.000000 0.000000 0.708361 Cd\n0.666667 0.333333 0.041764 Cd\n0.000000 0.000000 0.208348 Cd\n0.000000 0.000000 0.875016 Cd\n0.333333 0.666667 0.079736 I\n0.000000 0.000000 0.579534 I\n0.666667 0.333333 0.837022 I\n0.333333 0.666667 0.913006 I\n0.666667 0.333333 0.336978 I\n0.333333 0.666667 0.746353 I\n0.000000 0.000000 0.412935 I\n0.000000 0.000000 0.003772 I\n0.666667 0.333333 0.670378 I\n0.666667 0.333333 0.503583 I\n0.333333 0.666667 0.246335 I\n0.666667 0.333333 0.170368 I\n",
            "nsites": 18,
            "nelements": 2,
            "elements": [
                "Cd",
                "I"
            ],
            "chemical_system": "Cd-I",
            "density": 4.946305390502135,
            "density_atomic": 0.024401195069152566,
            "volume": 737.6687883109131,
            "volume_molar": 24.679695985927562,
            "formula_full": "Cd6 I12",
            "formula_reduced": "CdI2",
            "formula_anonymous": "AB2",
            "energy": -38.92832068,
            "energy_per_atom": -2.162684482222222,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -34.38032068,
            "band_gap": 2.393,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0267099,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:24.098000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1147673",
            "created_at": "2022-09-04T14:41:49.695887Z",
            "structure_string": "Cu6 O8\n1.0\n0.000000 4.509567 4.509567\n4.509567 0.000000 4.509567\n4.509567 4.509567 0.000000\nCu O\n6 8\ndirect\n0.500000 0.000000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.857569 0.427293 0.857569 O\n0.142431 0.142431 0.142431 O\n0.857569 0.857569 0.857569 O\n0.572707 0.142431 0.142431 O\n0.857569 0.857569 0.427293 O\n0.427293 0.857569 0.857569 O\n0.142431 0.142431 0.572707 O\n0.142431 0.572707 0.142431 O\n",
            "nsites": 14,
            "nelements": 2,
            "elements": [
                "Cu",
                "O"
            ],
            "chemical_system": "Cu-O",
            "density": 4.610666262193509,
            "density_atomic": 0.07632969178911125,
            "volume": 183.41486349348992,
            "volume_molar": 7.889643753099869,
            "formula_full": "Cu6 O8",
            "formula_reduced": "Cu3O4",
            "formula_anonymous": "A3B4",
            "energy": -75.35280349,
            "energy_per_atom": -5.382343106428571,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -69.85680349,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004389,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:28.592000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1199447",
            "created_at": "2022-09-04T14:41:50.899624Z",
            "structure_string": "Ho8 Au48\n1.0\n10.505339 0.000000 0.000000\n0.000000 10.505339 0.000000\n0.000000 0.000000 9.932024\nHo Au\n8 48\ndirect\n0.325270 0.825270 0.038183 Ho\n0.674730 0.825270 0.538183 Ho\n0.325270 0.174730 0.538183 Ho\n0.674730 0.174730 0.038183 Ho\n0.174730 0.674730 0.461817 Ho\n0.825270 0.674730 0.961817 Ho\n0.174730 0.325270 0.961817 Ho\n0.825270 0.325270 0.461817 Ho\n0.929405 0.763117 0.670899 Au\n0.070595 0.763117 0.170899 Au\n0.929405 0.236883 0.170899 Au\n0.070595 0.236883 0.670899 Au\n0.263117 0.429406 0.670899 Au\n0.263117 0.570595 0.170899 Au\n0.736883 0.429406 0.170899 Au\n0.736883 0.570595 0.670899 Au\n0.570595 0.736883 0.829101 Au\n0.429406 0.736883 0.329101 Au\n0.570595 0.263117 0.329101 Au\n0.429406 0.263117 0.829101 Au\n0.236883 0.070595 0.829101 Au\n0.236883 0.929405 0.329101 Au\n0.763117 0.070595 0.329101 Au\n0.763117 0.929405 0.829101 Au\n0.872170 0.050296 0.604525 Au\n0.127830 0.050296 0.104525 Au\n0.872170 0.949704 0.104525 Au\n0.127830 0.949704 0.604525 Au\n0.550296 0.372170 0.604525 Au\n0.550296 0.627830 0.104525 Au\n0.449704 0.372170 0.104525 Au\n0.449704 0.627830 0.604525 Au\n0.627830 0.449704 0.895475 Au\n0.372170 0.449704 0.395475 Au\n0.627830 0.550296 0.395475 Au\n0.372170 0.550296 0.895475 Au\n0.949704 0.127830 0.895475 Au\n0.949704 0.872170 0.395475 Au\n0.050296 0.127830 0.395475 Au\n0.050296 0.872170 0.895475 Au\n0.397970 0.897970 0.570483 Au\n0.602030 0.897970 0.070483 Au\n0.397970 0.102030 0.070483 Au\n0.602030 0.102030 0.570483 Au\n0.102030 0.602030 0.929517 Au\n0.897970 0.602030 0.429517 Au\n0.102030 0.397970 0.429517 Au\n0.897970 0.397970 0.929517 Au\n0.500000 0.000000 0.317989 Au\n0.500000 0.000000 0.817989 Au\n0.000000 0.500000 0.182011 Au\n0.000000 0.500000 0.682011 Au\n0.250000 0.750000 0.750000 Au\n0.750000 0.750000 0.250000 Au\n0.250000 0.250000 0.250000 Au\n0.750000 0.250000 0.750000 Au\n",
            "nsites": 56,
            "nelements": 2,
            "elements": [
                "Ho",
                "Au"
            ],
            "chemical_system": "Au-Ho",
            "density": 16.3215586631204,
            "density_atomic": 0.051089320203657834,
            "volume": 1096.1194977104153,
            "volume_molar": 11.787474830343962,
            "formula_full": "Ho8 Au48",
            "formula_reduced": "HoAu6",
            "formula_anonymous": "AB6",
            "energy": -217.33823436,
            "energy_per_atom": -3.8810398992857142,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -217.33823436,
            "band_gap": 0.1695000000000002,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0056816,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:32.505000Z",
            "spacegroup": 138
        },
        {
            "id": "mp-1203286",
            "created_at": "2022-09-04T14:41:45.768340Z",
            "structure_string": "Cu24 N8\n1.0\n7.446728 0.000000 0.000000\n0.000000 7.446728 0.000000\n0.000000 0.000000 7.410262\nCu N\n24 8\ndirect\n0.251354 0.500000 0.500000 Cu\n0.748646 0.500000 0.500000 Cu\n0.500000 0.748646 0.500000 Cu\n0.500000 0.251354 0.500000 Cu\n0.000000 0.500000 0.744954 Cu\n0.500000 0.000000 0.744954 Cu\n0.000000 0.500000 0.255046 Cu\n0.500000 0.000000 0.255046 Cu\n0.245160 0.000000 0.000000 Cu\n0.754840 0.000000 0.000000 Cu\n0.000000 0.754840 0.000000 Cu\n0.000000 0.245160 0.000000 Cu\n0.255288 0.500000 0.000000 Cu\n0.744712 0.500000 0.000000 Cu\n0.500000 0.744712 0.000000 Cu\n0.500000 0.255288 0.000000 Cu\n0.239253 0.239253 0.731579 Cu\n0.760747 0.760747 0.731579 Cu\n0.239253 0.760747 0.731579 Cu\n0.760747 0.239253 0.731579 Cu\n0.760747 0.760747 0.268421 Cu\n0.239253 0.239253 0.268421 Cu\n0.760747 0.239253 0.268421 Cu\n0.239253 0.760747 0.268421 Cu\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.500000 0.500000 0.500000 N\n0.000000 0.500000 0.500000 N\n0.500000 0.000000 0.500000 N\n0.000000 0.500000 0.000000 N\n0.500000 0.000000 0.000000 N\n",
            "nsites": 32,
            "nelements": 2,
            "elements": [
                "Cu",
                "N"
            ],
            "chemical_system": "Cu-N",
            "density": 6.615688382983894,
            "density_atomic": 0.07787273587909944,
            "volume": 410.92687496791285,
            "volume_molar": 7.733310884761536,
            "formula_full": "Cu24 N8",
            "formula_reduced": "Cu3N",
            "formula_anonymous": "AB3",
            "energy": -147.76121862,
            "energy_per_atom": -4.617538081875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -144.87321862,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.2177999,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:23.593000Z",
            "spacegroup": 123
        },
        {
            "id": "mp-1199847",
            "created_at": "2022-09-04T14:41:49.679549Z",
            "structure_string": "Dy20 Pb16\n1.0\n-8.207078 0.000000 0.000000\n0.000000 0.000000 -8.276950\n0.000000 -15.709014 0.000000\nDy Pb\n20 16\ndirect\n0.376374 0.841169 0.879474 Dy\n0.876374 0.658831 0.620526 Dy\n0.623626 0.158831 0.379474 Dy\n0.123626 0.341169 0.120526 Dy\n0.623626 0.158831 0.120526 Dy\n0.123626 0.341169 0.379474 Dy\n0.376374 0.841169 0.620526 Dy\n0.876374 0.658831 0.879474 Dy\n0.536355 0.322988 0.899873 Dy\n0.036355 0.177012 0.600127 Dy\n0.463645 0.677012 0.399873 Dy\n0.963645 0.822988 0.100127 Dy\n0.463645 0.677012 0.100127 Dy\n0.963645 0.822988 0.399873 Dy\n0.536355 0.322988 0.600127 Dy\n0.036355 0.177012 0.899873 Dy\n0.208382 0.504092 0.750000 Dy\n0.708382 0.995908 0.750000 Dy\n0.791618 0.495908 0.250000 Dy\n0.291618 0.004092 0.250000 Dy\n0.281311 0.032210 0.042497 Pb\n0.781311 0.467790 0.457503 Pb\n0.718689 0.967790 0.542497 Pb\n0.218689 0.532210 0.957503 Pb\n0.718689 0.967790 0.957503 Pb\n0.218689 0.532210 0.542497 Pb\n0.281311 0.032210 0.457503 Pb\n0.781311 0.467790 0.042497 Pb\n0.570800 0.626333 0.750000 Pb\n0.070800 0.873667 0.750000 Pb\n0.429200 0.373667 0.250000 Pb\n0.929200 0.126333 0.250000 Pb\n0.346423 0.153142 0.750000 Pb\n0.846423 0.346858 0.750000 Pb\n0.653577 0.846858 0.250000 Pb\n0.153577 0.653142 0.250000 Pb\n",
            "nsites": 36,
            "nelements": 2,
            "elements": [
                "Dy",
                "Pb"
            ],
            "chemical_system": "Dy-Pb",
            "density": 10.216196529491958,
            "density_atomic": 0.033736084931649736,
            "volume": 1067.1066329402781,
            "volume_molar": 17.850739859711133,
            "formula_full": "Dy20 Pb16",
            "formula_reduced": "Dy5Pb4",
            "formula_anonymous": "A4B5",
            "energy": -170.56068841,
            "energy_per_atom": -4.737796900277778,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -170.56068841,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.3790382,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:36.331000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1207597",
            "created_at": "2022-09-04T14:41:50.883748Z",
            "structure_string": "Yb8 Al2\n1.0\n-6.067799 -6.067799 0.000000\n-6.067799 0.000000 -6.067799\n0.000000 -6.067799 -6.067799\nYb Al\n8 2\ndirect\n0.609532 0.609532 0.609532 Yb\n0.171404 0.609532 0.609532 Yb\n0.609532 0.171404 0.609532 Yb\n0.578596 0.140468 0.140468 Yb\n0.140468 0.140468 0.140468 Yb\n0.609532 0.609532 0.171404 Yb\n0.140468 0.578596 0.140468 Yb\n0.140468 0.140468 0.578596 Yb\n0.000000 0.000000 0.000000 Al\n0.750000 0.750000 0.750000 Al\n",
            "nsites": 10,
            "nelements": 2,
            "elements": [
                "Yb",
                "Al"
            ],
            "chemical_system": "Al-Yb",
            "density": 5.3452732871505795,
            "density_atomic": 0.02238084328272792,
            "volume": 446.8106886623593,
            "volume_molar": 26.907568601972642,
            "formula_full": "Yb8 Al2",
            "formula_reduced": "Yb4Al",
            "formula_anonymous": "AB4",
            "energy": -15.95637754,
            "energy_per_atom": -1.595637754,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -15.95637754,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0016347,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:30.126000Z",
            "spacegroup": 227
        },
        {
            "id": "mp-556048",
            "created_at": "2022-09-04T14:41:49.556736Z",
            "structure_string": "Nb16 O40\n1.0\n-10.386535 10.386535 1.928516\n10.386535 -10.386535 1.928516\n10.386535 10.386535 -1.928516\nNb O\n16 40\ndirect\n0.266119 0.864866 0.130985 Nb\n0.000000 0.868751 0.868751 Nb\n0.000000 0.400257 0.400257 Nb\n0.400257 0.000000 0.400257 Nb\n0.864866 0.733881 0.598747 Nb\n0.599743 0.000000 0.599743 Nb\n0.135134 0.266119 0.401253 Nb\n0.131249 0.000000 0.131249 Nb\n0.000000 0.131249 0.131249 Nb\n0.868751 0.000000 0.868751 Nb\n0.864866 0.266119 0.130985 Nb\n0.000000 0.599743 0.599743 Nb\n0.733881 0.864866 0.598747 Nb\n0.733881 0.135134 0.869015 Nb\n0.266119 0.135134 0.401253 Nb\n0.135134 0.733881 0.869015 Nb\n0.069785 0.791007 0.860792 O\n0.206310 0.206310 0.412620 O\n0.930215 0.208993 0.139208 O\n0.351594 0.789576 0.141170 O\n0.793690 0.793690 0.587380 O\n0.791007 0.069785 0.860792 O\n0.208993 0.930215 0.139208 O\n0.789576 0.351594 0.141170 O\n0.210424 0.351594 0.562018 O\n0.930664 0.069336 0.000000 O\n0.500000 0.644709 0.144709 O\n0.069336 0.069336 0.138673 O\n0.931653 0.346785 0.278438 O\n0.500000 0.066714 0.566714 O\n0.206310 0.793690 0.000000 O\n0.930664 0.930664 0.861327 O\n0.500000 0.355291 0.855291 O\n0.931653 0.653215 0.584868 O\n0.648406 0.789576 0.437982 O\n0.789576 0.648406 0.437982 O\n0.644709 0.500000 0.144709 O\n0.346785 0.931653 0.278438 O\n0.068347 0.653215 0.721562 O\n0.653215 0.068347 0.721562 O\n0.933286 0.500000 0.433286 O\n0.068347 0.346785 0.415132 O\n0.069336 0.930664 0.000000 O\n0.930215 0.791007 0.721223 O\n0.351594 0.210424 0.562018 O\n0.791007 0.930215 0.721223 O\n0.500000 0.933286 0.433286 O\n0.069785 0.208993 0.278777 O\n0.653215 0.931653 0.584868 O\n0.793690 0.206310 0.000000 O\n0.210424 0.648406 0.858830 O\n0.066714 0.500000 0.566714 O\n0.208993 0.069785 0.278777 O\n0.346785 0.068347 0.415132 O\n0.648406 0.210424 0.858830 O\n0.355291 0.500000 0.855291 O\n",
            "nsites": 56,
            "nelements": 2,
            "elements": [
                "Nb",
                "O"
            ],
            "chemical_system": "Nb-O",
            "density": 4.243120762266188,
            "density_atomic": 0.06729199616527684,
            "volume": 832.1940675152152,
            "volume_molar": 8.949267525381375,
            "formula_full": "Nb16 O40",
            "formula_reduced": "Nb2O5",
            "formula_anonymous": "A2B5",
            "energy": -529.08888051,
            "energy_per_atom": -9.448015723392857,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -501.60888051,
            "band_gap": 1.6652,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0024408,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:28.749000Z",
            "spacegroup": 139
        },
        {
            "id": "mp-1181824",
            "created_at": "2022-09-04T14:41:49.529476Z",
            "structure_string": "Fe4 O6\n1.0\n7.608352 3.762157 11.982754\n-1.037980 2.873760 4.397800\n-4.660776 -4.078696 -4.757512\nFe O\n4 6\ndirect\n0.577745 0.105140 0.505158 Fe\n0.422255 0.894860 0.494842 Fe\n0.072586 0.605140 0.494842 Fe\n0.927414 0.394860 0.505158 Fe\n0.251102 0.996873 0.997316 O\n0.237284 0.250000 0.474567 O\n0.746214 0.503127 0.997316 O\n0.748898 0.003127 0.002684 O\n0.762716 0.750000 0.525433 O\n0.253786 0.496873 0.002684 O\n",
            "nsites": 10,
            "nelements": 2,
            "elements": [
                "Fe",
                "O"
            ],
            "chemical_system": "Fe-O",
            "density": 3.5836712544749023,
            "density_atomic": 0.0675734736175613,
            "volume": 147.9870645187782,
            "volume_molar": 8.911989331912839,
            "formula_full": "Fe4 O6",
            "formula_reduced": "Fe2O3",
            "formula_anonymous": "A2B3",
            "energy": -78.95749931,
            "energy_per_atom": -7.895749931,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -65.81149931,
            "band_gap": 1.6876999999999998,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 19.9999811,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:23.162000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-573471",
            "created_at": "2022-09-04T14:41:49.507402Z",
            "structure_string": "Li85 Sn20\n1.0\n0.000000 9.831809 9.831809\n9.831809 0.000000 9.831809\n9.831809 9.831809 0.000000\nLi Sn\n85 20\ndirect\n0.423818 0.076182 0.423818 Li\n0.418607 0.761922 0.761922 Li\n0.076182 0.423818 0.076182 Li\n0.828763 0.171237 0.171237 Li\n0.007278 0.007278 0.666303 Li\n0.555938 0.332187 0.555938 Li\n0.074462 0.074462 0.074462 Li\n0.007278 0.666303 0.007278 Li\n0.518206 0.827265 0.827265 Li\n0.518705 0.518705 0.789273 Li\n0.920003 0.265594 0.548810 Li\n0.417190 0.748430 0.417190 Li\n0.265594 0.548810 0.265594 Li\n0.827265 0.827265 0.827265 Li\n0.319140 0.007278 0.007278 Li\n0.828763 0.171237 0.828763 Li\n0.518705 0.789273 0.518705 Li\n0.173316 0.518705 0.518705 Li\n0.518705 0.173316 0.518705 Li\n0.303240 0.303240 0.303240 Li\n0.417190 0.417190 0.417190 Li\n0.171237 0.171237 0.828763 Li\n0.518705 0.173316 0.789273 Li\n0.423818 0.076182 0.076182 Li\n0.319140 0.666303 0.007278 Li\n0.827265 0.827265 0.518206 Li\n0.761922 0.761922 0.057550 Li\n0.681977 0.681977 0.954068 Li\n0.666303 0.007278 0.319140 Li\n0.418607 0.761922 0.057550 Li\n0.418607 0.057550 0.761922 Li\n0.776613 0.074462 0.074462 Li\n0.681977 0.954068 0.681977 Li\n0.265594 0.265594 0.920003 Li\n0.303240 0.303240 0.090281 Li\n0.827265 0.518206 0.827265 Li\n0.171237 0.828763 0.171237 Li\n0.007278 0.666303 0.319140 Li\n0.076182 0.076182 0.423818 Li\n0.423818 0.423818 0.076182 Li\n0.074462 0.776613 0.074462 Li\n0.332187 0.555938 0.555938 Li\n0.920003 0.548810 0.265594 Li\n0.761922 0.057550 0.418607 Li\n0.417190 0.417190 0.748430 Li\n0.057550 0.418607 0.761922 Li\n0.265594 0.265594 0.548810 Li\n0.007278 0.319140 0.007278 Li\n0.173316 0.518705 0.789273 Li\n0.555938 0.555938 0.555938 Li\n0.173316 0.789273 0.518705 Li\n0.303240 0.090281 0.303240 Li\n0.555938 0.555938 0.332187 Li\n0.748430 0.417190 0.417190 Li\n0.761922 0.761922 0.418607 Li\n0.666303 0.007278 0.007278 Li\n0.548810 0.265594 0.265594 Li\n0.666303 0.319140 0.007278 Li\n0.920003 0.265594 0.265594 Li\n0.789273 0.173316 0.518705 Li\n0.548810 0.265594 0.920003 Li\n0.518705 0.789273 0.173316 Li\n0.265594 0.920003 0.548810 Li\n0.761922 0.418607 0.761922 Li\n0.518705 0.518705 0.173316 Li\n0.076182 0.423818 0.423818 Li\n0.074462 0.074462 0.776613 Li\n0.057550 0.761922 0.418607 Li\n0.681977 0.681977 0.681977 Li\n0.548810 0.920003 0.265594 Li\n0.265594 0.548810 0.920003 Li\n0.828763 0.828763 0.171237 Li\n0.319140 0.007278 0.666303 Li\n0.761922 0.057550 0.761922 Li\n0.090281 0.303240 0.303240 Li\n0.000000 0.000000 0.000000 Li\n0.789273 0.518705 0.173316 Li\n0.007278 0.319140 0.666303 Li\n0.789273 0.518705 0.518705 Li\n0.171237 0.828763 0.828763 Li\n0.954068 0.681977 0.681977 Li\n0.265594 0.920003 0.265594 Li\n0.007278 0.007278 0.319140 Li\n0.761922 0.418607 0.057550 Li\n0.057550 0.761922 0.761922 Li\n0.160119 0.519642 0.160119 Sn\n0.679180 0.320820 0.679180 Sn\n0.160119 0.160119 0.160119 Sn\n0.250972 0.916343 0.916343 Sn\n0.929774 0.570226 0.570226 Sn\n0.929774 0.929774 0.570226 Sn\n0.679180 0.320820 0.320820 Sn\n0.679180 0.679180 0.320820 Sn\n0.570226 0.570226 0.929774 Sn\n0.320820 0.679180 0.320820 Sn\n0.916343 0.916343 0.916343 Sn\n0.916343 0.250972 0.916343 Sn\n0.519642 0.160119 0.160119 Sn\n0.320820 0.320820 0.679180 Sn\n0.320820 0.679180 0.679180 Sn\n0.160119 0.160119 0.519642 Sn\n0.916343 0.916343 0.250972 Sn\n0.570226 0.929774 0.929774 Sn\n0.929774 0.570226 0.929774 Sn\n0.570226 0.929774 0.570226 Sn\n",
            "nsites": 105,
            "nelements": 2,
            "elements": [
                "Li",
                "Sn"
            ],
            "chemical_system": "Li-Sn",
            "density": 2.5895488490797662,
            "density_atomic": 0.055240678511684314,
            "volume": 1900.773177103369,
            "volume_molar": 10.901641547951332,
            "formula_full": "Li85 Sn20",
            "formula_reduced": "Li17Sn4",
            "formula_anonymous": "A4B17",
            "energy": -279.7377062,
            "energy_per_atom": -2.6641686304761905,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -279.7377062,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 2.477088,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:27.433000Z",
            "spacegroup": 216
        }
    ]
}