GET /third-parties/MatprojStructure/?format=api&ordering=total_magnetization&page=12120
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=total_magnetization&page=12121",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=total_magnetization&page=12119",
    "results": [
        {
            "id": "mp-757563",
            "created_at": "2022-09-04T14:48:30.915725Z",
            "structure_string": "Li24 Co24 P24 O96\n1.0\n4.997003 -8.655064 0.000000\n4.997003 8.655064 0.000000\n0.000000 0.000000 22.713206\nLi Co P O\n24 24 24 96\ndirect\n0.007742 0.947722 0.418730 Li\n0.062131 0.561701 0.916984 Li\n0.061252 0.515475 0.256377 Li\n0.024427 0.480806 0.587190 Li\n0.456379 0.975573 0.920524 Li\n0.454224 0.938748 0.589711 Li\n0.052278 0.060019 0.085396 Li\n0.499570 0.937869 0.250317 Li\n0.060019 0.007742 0.252063 Li\n0.438299 0.500430 0.583650 Li\n0.484525 0.545776 0.923044 Li\n0.519194 0.543621 0.253857 Li\n0.480806 0.456379 0.753857 Li\n0.515475 0.454224 0.423044 Li\n0.561701 0.499570 0.083650 Li\n0.939981 0.992258 0.752063 Li\n0.500430 0.062131 0.750317 Li\n0.947722 0.939981 0.585396 Li\n0.545776 0.061252 0.089711 Li\n0.543621 0.024427 0.420524 Li\n0.975573 0.519194 0.087190 Li\n0.938748 0.484525 0.756377 Li\n0.937869 0.438299 0.416984 Li\n0.992258 0.052278 0.918730 Li\n0.146937 0.834324 0.679483 Co\n0.189385 0.884968 0.010692 Co\n0.176723 0.789331 0.375952 Co\n0.115032 0.304417 0.677358 Co\n0.329734 0.673305 0.820013 Co\n0.326695 0.656429 0.486680 Co\n0.343571 0.670266 0.153347 Co\n0.165676 0.312613 0.346150 Co\n0.210669 0.387392 0.042618 Co\n0.612608 0.823277 0.709285 Co\n0.304417 0.189385 0.844025 Co\n0.312613 0.146937 0.512816 Co\n0.687387 0.853063 0.012816 Co\n0.695583 0.810615 0.344025 Co\n0.387392 0.176723 0.209285 Co\n0.789331 0.612608 0.542618 Co\n0.834324 0.687387 0.846150 Co\n0.656429 0.329734 0.653347 Co\n0.673305 0.343571 0.986680 Co\n0.670266 0.326695 0.320013 Co\n0.884968 0.695583 0.177358 Co\n0.823277 0.210669 0.875952 Co\n0.810615 0.115032 0.510692 Co\n0.853063 0.165676 0.179483 Co\n0.171931 0.856274 0.813047 P\n0.131956 0.778922 0.509032 P\n0.217977 0.881357 0.146335 P\n0.118643 0.336620 0.813002 P\n0.328208 0.687397 0.009593 P\n0.143726 0.315657 0.479714 P\n0.312603 0.640811 0.676260 P\n0.359189 0.671792 0.342927 P\n0.221078 0.353034 0.175699 P\n0.646966 0.868044 0.842366 P\n0.336620 0.217977 0.979669 P\n0.315657 0.171931 0.646380 P\n0.684343 0.828069 0.146380 P\n0.663380 0.782023 0.479669 P\n0.353034 0.131956 0.342366 P\n0.778922 0.646966 0.675699 P\n0.640811 0.328208 0.842927 P\n0.687397 0.359189 0.176260 P\n0.856274 0.684343 0.979714 P\n0.671792 0.312603 0.509593 P\n0.881357 0.663380 0.313002 P\n0.782023 0.118643 0.646335 P\n0.868044 0.221078 0.009032 P\n0.828069 0.143726 0.313047 P\n0.015524 0.707311 0.798514 O\n0.134372 0.973975 0.842769 O\n0.012392 0.678726 0.556975 O\n0.132996 0.933794 0.498352 O\n0.180528 0.990300 0.183037 O\n0.066208 0.728052 0.131939 O\n0.084258 0.680075 0.451584 O\n0.260565 0.923337 0.754138 O\n0.293504 0.961077 0.087111 O\n0.157364 0.640281 0.674313 O\n0.206175 0.709675 0.975629 O\n0.277045 0.823874 0.854125 O\n0.208748 0.656572 0.316658 O\n0.295199 0.812814 0.528361 O\n0.038923 0.332427 0.753777 O\n0.334759 0.852865 0.181663 O\n0.147135 0.481894 0.848330 O\n0.009700 0.190228 0.849704 O\n0.076663 0.337229 0.420805 O\n0.026025 0.160397 0.509435 O\n0.261929 0.630663 0.072644 O\n0.066206 0.199202 0.165018 O\n0.176126 0.453171 0.520792 O\n0.187186 0.482385 0.195028 O\n0.368734 0.738071 0.405978 O\n0.290325 0.496501 0.642295 O\n0.369337 0.631266 0.739311 O\n0.343428 0.552176 0.983324 O\n0.447824 0.791252 0.649991 O\n0.482916 0.842636 0.007646 O\n0.359719 0.517084 0.340980 O\n0.160397 0.134372 0.676102 O\n0.190228 0.180528 0.016371 O\n0.271948 0.338156 0.798606 O\n0.319925 0.404183 0.118251 O\n0.503499 0.793825 0.308962 O\n0.199202 0.132996 0.331685 O\n0.292689 0.308213 0.465181 O\n0.321274 0.333666 0.223642 O\n0.517615 0.704801 0.861694 O\n0.595817 0.915742 0.784917 O\n0.546829 0.722955 0.187459 O\n0.332427 0.293504 0.920444 O\n0.666334 0.987608 0.890308 O\n0.518106 0.665241 0.514997 O\n0.337229 0.260565 0.587471 O\n0.661844 0.933792 0.465272 O\n0.691787 0.984476 0.131847 O\n0.308213 0.015524 0.631847 O\n0.338156 0.066208 0.965272 O\n0.662771 0.739435 0.087471 O\n0.481894 0.334759 0.014997 O\n0.333666 0.012392 0.390308 O\n0.667573 0.706496 0.420444 O\n0.453171 0.277045 0.687459 O\n0.404183 0.084258 0.284917 O\n0.482385 0.295199 0.361694 O\n0.678726 0.666334 0.723642 O\n0.707311 0.691787 0.965181 O\n0.800798 0.867004 0.831685 O\n0.496501 0.206175 0.808962 O\n0.680075 0.595817 0.618251 O\n0.728052 0.661844 0.298606 O\n0.809772 0.819472 0.516371 O\n0.839603 0.865628 0.176102 O\n0.640281 0.482916 0.840980 O\n0.517084 0.157364 0.507646 O\n0.552176 0.208748 0.149991 O\n0.656572 0.447824 0.483324 O\n0.630663 0.368734 0.239311 O\n0.709675 0.503499 0.142295 O\n0.631266 0.261929 0.905978 O\n0.812814 0.517615 0.695028 O\n0.823874 0.546829 0.020792 O\n0.933794 0.800798 0.665018 O\n0.738071 0.369337 0.572644 O\n0.973975 0.839603 0.009435 O\n0.923337 0.662771 0.920805 O\n0.990300 0.809772 0.349704 O\n0.852865 0.518106 0.348330 O\n0.665241 0.147135 0.681663 O\n0.961077 0.667573 0.253777 O\n0.704801 0.187186 0.028361 O\n0.791252 0.343428 0.816658 O\n0.722955 0.176126 0.354125 O\n0.793825 0.290325 0.475629 O\n0.842636 0.359719 0.174313 O\n0.706496 0.038923 0.587111 O\n0.739435 0.076663 0.254138 O\n0.915742 0.319925 0.951584 O\n0.933792 0.271948 0.631939 O\n0.819472 0.009700 0.683037 O\n0.867004 0.066206 0.998352 O\n0.987608 0.321274 0.056975 O\n0.865628 0.026025 0.342769 O\n0.984476 0.292689 0.298514 O\n",
            "nsites": 168,
            "nelements": 4,
            "elements": [
                "Li",
                "Co",
                "P",
                "O"
            ],
            "chemical_system": "Co-Li-O-P",
            "density": 3.2627295695369845,
            "density_atomic": 0.08551079664232972,
            "volume": 1964.6641897478983,
            "volume_molar": 7.042550176662615,
            "formula_full": "Li24 Co24 P24 O96",
            "formula_reduced": "LiCoPO4",
            "formula_anonymous": "ABCD4",
            "energy": -1203.82158164,
            "energy_per_atom": -7.165604652619048,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -1098.55758164,
            "band_gap": 2.9125,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.0558293,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:54.278000Z",
            "spacegroup": 170
        },
        {
            "id": "mp-21757",
            "created_at": "2022-09-04T14:46:53.369988Z",
            "structure_string": "Eu12 Al20 O48\n1.0\n-6.138773 6.138773 6.138773\n6.138773 -6.138773 6.138773\n6.138773 6.138773 -6.138773\nEu Al O\n12 20 48\ndirect\n0.875000 0.625000 0.250000 Eu\n0.625000 0.250000 0.875000 Eu\n0.875000 0.750000 0.625000 Eu\n0.750000 0.625000 0.875000 Eu\n0.250000 0.875000 0.625000 Eu\n0.625000 0.875000 0.750000 Eu\n0.125000 0.375000 0.750000 Eu\n0.375000 0.750000 0.125000 Eu\n0.125000 0.250000 0.375000 Eu\n0.250000 0.375000 0.125000 Eu\n0.750000 0.125000 0.375000 Eu\n0.375000 0.125000 0.250000 Eu\n0.125000 0.875000 0.250000 Al\n0.875000 0.125000 0.750000 Al\n0.250000 0.625000 0.375000 Al\n0.375000 0.250000 0.625000 Al\n0.750000 0.875000 0.125000 Al\n0.125000 0.750000 0.875000 Al\n0.375000 0.625000 0.750000 Al\n0.625000 0.750000 0.375000 Al\n0.875000 0.250000 0.125000 Al\n0.250000 0.125000 0.875000 Al\n0.750000 0.375000 0.625000 Al\n0.625000 0.375000 0.250000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.000000 0.000000 0.000000 Al\n0.920190 0.115472 0.600491 O\n0.180301 0.195282 0.579810 O\n0.304718 0.485019 0.384528 O\n0.014981 0.319699 0.899509 O\n0.384528 0.579810 0.899509 O\n0.319699 0.899509 0.014981 O\n0.319699 0.920190 0.304718 O\n0.899509 0.014981 0.319699 O\n0.115472 0.014981 0.195282 O\n0.485019 0.600491 0.180301 O\n0.600491 0.180301 0.485019 O\n0.899509 0.384528 0.579810 O\n0.920190 0.304718 0.319699 O\n0.195282 0.115472 0.014981 O\n0.579810 0.899509 0.384528 O\n0.304718 0.319699 0.920190 O\n0.014981 0.195282 0.115472 O\n0.579810 0.180301 0.195282 O\n0.485019 0.384528 0.304718 O\n0.884528 0.985019 0.804718 O\n0.384528 0.304718 0.485019 O\n0.600491 0.920190 0.115472 O\n0.195282 0.579810 0.180301 O\n0.180301 0.485019 0.600491 O\n0.079810 0.884528 0.399509 O\n0.819699 0.804718 0.420190 O\n0.695282 0.514981 0.615472 O\n0.985019 0.680301 0.100491 O\n0.615472 0.420190 0.100491 O\n0.680301 0.100491 0.985019 O\n0.680301 0.079810 0.695282 O\n0.100491 0.985019 0.680301 O\n0.819699 0.514981 0.399509 O\n0.804718 0.420190 0.819699 O\n0.399509 0.079810 0.884528 O\n0.884528 0.399509 0.079810 O\n0.615472 0.695282 0.514981 O\n0.514981 0.615472 0.695282 O\n0.420190 0.819699 0.804718 O\n0.985019 0.804718 0.884528 O\n0.695282 0.680301 0.079810 O\n0.420190 0.100491 0.615472 O\n0.804718 0.884528 0.985019 O\n0.079810 0.695282 0.680301 O\n0.100491 0.615472 0.420190 O\n0.399509 0.819699 0.514981 O\n0.514981 0.399509 0.819699 O\n0.115472 0.600491 0.920190 O\n",
            "nsites": 80,
            "nelements": 3,
            "elements": [
                "Eu",
                "Al",
                "O"
            ],
            "chemical_system": "Al-Eu-O",
            "density": 5.618896424882195,
            "density_atomic": 0.08645403603326318,
            "volume": 925.3471980095875,
            "volume_molar": 6.96571384785666,
            "formula_full": "Eu12 Al20 O48",
            "formula_reduced": "Eu3Al5O12",
            "formula_anonymous": "A3B5C12",
            "energy": -707.32394988,
            "energy_per_atom": -8.8415493735,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -674.34794988,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.1026187,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:44.756000Z",
            "spacegroup": 230
        },
        {
            "id": "mp-705430",
            "created_at": "2022-09-04T14:47:04.676995Z",
            "structure_string": "Mn24 O48\n1.0\n2.924109 -5.064706 0.000000\n2.924109 5.064706 0.000000\n0.000000 0.000000 28.638432\nMn O\n24 48\ndirect\n0.009428 0.504714 0.083092 Mn\n0.495286 0.504714 0.083092 Mn\n0.495286 0.990572 0.083092 Mn\n0.340942 0.170471 0.249314 Mn\n0.829529 0.170471 0.249314 Mn\n0.829529 0.659058 0.249314 Mn\n0.667008 0.833504 0.416362 Mn\n0.000000 0.000000 0.142051 Mn\n0.000000 0.000000 0.332345 Mn\n0.166496 0.833504 0.416362 Mn\n0.000196 0.500098 0.583222 Mn\n0.166496 0.332992 0.416362 Mn\n0.499902 0.500098 0.583222 Mn\n0.333333 0.666667 0.499729 Mn\n0.333484 0.166742 0.749926 Mn\n0.499902 0.999804 0.583222 Mn\n0.666667 0.333333 0.666478 Mn\n0.833258 0.166742 0.749926 Mn\n0.833258 0.666516 0.749926 Mn\n0.666185 0.833092 0.916703 Mn\n0.166908 0.833092 0.916703 Mn\n0.000000 0.000000 0.833235 Mn\n0.166908 0.333815 0.916703 Mn\n0.666667 0.333333 0.977900 Mn\n0.180289 0.360577 0.049472 O\n0.180289 0.819711 0.049472 O\n0.333333 0.666667 0.118715 O\n0.639423 0.819711 0.049472 O\n0.356178 0.178089 0.120333 O\n0.510292 0.020585 0.216327 O\n0.666667 0.333333 0.048616 O\n0.510292 0.489708 0.216327 O\n0.666667 0.333333 0.284515 O\n0.821911 0.178089 0.120333 O\n0.979415 0.489708 0.216327 O\n0.821911 0.643822 0.120333 O\n0.853828 0.707657 0.377350 O\n0.710124 0.855062 0.288322 O\n0.000000 0.000000 0.450463 O\n0.000000 0.000000 0.212579 O\n0.853828 0.146172 0.377350 O\n0.144938 0.855062 0.288322 O\n0.292343 0.146172 0.377350 O\n0.144938 0.289876 0.288322 O\n0.041365 0.520682 0.455695 O\n0.187124 0.374248 0.544242 O\n0.333333 0.666667 0.382415 O\n0.333333 0.666667 0.617292 O\n0.187124 0.812876 0.544242 O\n0.479318 0.520682 0.455695 O\n0.625752 0.812876 0.544242 O\n0.479318 0.958635 0.455695 O\n0.374606 0.187303 0.622475 O\n0.520469 0.040938 0.710937 O\n0.666667 0.333333 0.549248 O\n0.812697 0.187303 0.622475 O\n0.520469 0.479531 0.710937 O\n0.666667 0.333333 0.783990 O\n0.812697 0.625394 0.622475 O\n0.959062 0.479531 0.710937 O\n0.854012 0.708024 0.877612 O\n0.707914 0.853957 0.789175 O\n0.000000 0.000000 0.951244 O\n0.000000 0.000000 0.715949 O\n0.146043 0.853957 0.789175 O\n0.854012 0.145988 0.877612 O\n0.146043 0.292086 0.789175 O\n0.291976 0.145988 0.877612 O\n0.022544 0.511272 0.952258 O\n0.488728 0.511272 0.952258 O\n0.333333 0.666667 0.883120 O\n0.488728 0.977456 0.952258 O\n",
            "nsites": 72,
            "nelements": 2,
            "elements": [
                "Mn",
                "O"
            ],
            "chemical_system": "Mn-O",
            "density": 4.084483868593693,
            "density_atomic": 0.08488001881292405,
            "volume": 848.2561739140083,
            "volume_molar": 7.094886222012775,
            "formula_full": "Mn24 O48",
            "formula_reduced": "MnO2",
            "formula_anonymous": "AB2",
            "energy": -580.56835268,
            "energy_per_atom": -8.063449342777778,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -507.56035268,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.104808,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:49.469000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1203434",
            "created_at": "2022-09-04T14:40:35.204026Z",
            "structure_string": "Na16 Fe16 F56\n1.0\n3.753180 6.430974 0.000000\n-3.753180 6.430974 0.000000\n0.000000 4.348841 24.682504\nNa Fe F\n16 16 56\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.500000 0.500000 Na\n0.500000 0.000000 0.000000 Na\n0.784743 0.215257 0.250000 Na\n0.215257 0.784743 0.750000 Na\n0.789605 0.704072 0.252321 Na\n0.295928 0.210395 0.247679 Na\n0.210395 0.295928 0.747679 Na\n0.704072 0.789605 0.752321 Na\n0.133591 0.119737 0.121477 Na\n0.880263 0.866409 0.378523 Na\n0.866409 0.880263 0.878523 Na\n0.119737 0.133591 0.621477 Na\n0.628731 0.614957 0.127416 Fe\n0.385043 0.371269 0.372584 Fe\n0.371269 0.385043 0.872584 Fe\n0.614957 0.628731 0.627416 Fe\n0.134885 0.613197 0.125518 Fe\n0.386803 0.865115 0.374482 Fe\n0.865115 0.386803 0.874482 Fe\n0.613197 0.134885 0.625518 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n0.245252 0.754748 0.250000 Fe\n0.754748 0.245252 0.750000 Fe\n0.635606 0.111005 0.125791 Fe\n0.888995 0.364394 0.374209 Fe\n0.364394 0.888995 0.874209 Fe\n0.111005 0.635606 0.625791 Fe\n0.745975 0.581153 0.047081 F\n0.418847 0.254025 0.452919 F\n0.254025 0.418847 0.952919 F\n0.581153 0.745975 0.547081 F\n0.522686 0.639083 0.209148 F\n0.360917 0.477314 0.290852 F\n0.477314 0.360917 0.790852 F\n0.639083 0.522686 0.709148 F\n0.728296 0.298767 0.141992 F\n0.701233 0.271704 0.358008 F\n0.271704 0.701233 0.858008 F\n0.298767 0.728296 0.641992 F\n0.533012 0.928498 0.110441 F\n0.071502 0.466988 0.389559 F\n0.466988 0.071502 0.889559 F\n0.928498 0.533012 0.610441 F\n0.137968 0.577763 0.044599 F\n0.422237 0.862032 0.455401 F\n0.862032 0.422237 0.955401 F\n0.577763 0.137968 0.544599 F\n0.135516 0.639556 0.207027 F\n0.360444 0.864484 0.292973 F\n0.864484 0.360444 0.792973 F\n0.639556 0.135516 0.707027 F\n0.932428 0.925355 0.108977 F\n0.074645 0.067572 0.391023 F\n0.067572 0.074645 0.891023 F\n0.925355 0.932428 0.608977 F\n0.339122 0.300263 0.141873 F\n0.699737 0.660878 0.358127 F\n0.660878 0.699737 0.858127 F\n0.300263 0.339122 0.641873 F\n0.910040 0.528599 0.156560 F\n0.471401 0.089960 0.343440 F\n0.089960 0.471401 0.843440 F\n0.528599 0.910040 0.656560 F\n0.358061 0.697357 0.093049 F\n0.302643 0.641939 0.406951 F\n0.641939 0.302643 0.906951 F\n0.697357 0.358061 0.593049 F\n0.129700 0.206887 0.032031 F\n0.793113 0.870300 0.467969 F\n0.870300 0.793113 0.967969 F\n0.206887 0.129700 0.532031 F\n0.976572 0.861961 0.291462 F\n0.138039 0.023428 0.208538 F\n0.023428 0.138039 0.708538 F\n0.861961 0.976572 0.791462 F\n0.640912 0.025416 0.204081 F\n0.974584 0.359088 0.295919 F\n0.359088 0.974584 0.795919 F\n0.025416 0.640912 0.704081 F\n0.634394 0.189715 0.046987 F\n0.810285 0.365606 0.453013 F\n0.365606 0.810285 0.953013 F\n0.189715 0.634394 0.546987 F\n",
            "nsites": 88,
            "nelements": 3,
            "elements": [
                "Na",
                "Fe",
                "F"
            ],
            "chemical_system": "F-Fe-Na",
            "density": 3.2406083431758796,
            "density_atomic": 0.07385626027139076,
            "volume": 1191.5036000555258,
            "volume_molar": 8.153866358614907,
            "formula_full": "Na16 Fe16 F56",
            "formula_reduced": "Na2Fe2F7",
            "formula_anonymous": "A2B2C7",
            "energy": -507.61232182,
            "energy_per_atom": -5.768321838863636,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -445.64432182,
            "band_gap": 1.4233,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.1207103,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:02.534000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1195842",
            "created_at": "2022-09-04T14:48:07.849172Z",
            "structure_string": "Lu4 Fe34\n1.0\n0.000000 0.000000 -8.287435\n-4.162597 -7.211817 0.000000\n-4.162597 7.211817 0.000000\nLu Fe\n4 34\ndirect\n0.750000 0.999979 0.000021 Lu\n0.250000 0.000021 0.999979 Lu\n0.250000 0.666640 0.333360 Lu\n0.750000 0.333360 0.666640 Lu\n0.607667 0.666678 0.333322 Fe\n0.392333 0.333322 0.666678 Fe\n0.107667 0.333322 0.666678 Fe\n0.892333 0.666678 0.333322 Fe\n0.500000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.750000 0.670691 0.031373 Fe\n0.750000 0.360837 0.329472 Fe\n0.750000 0.968467 0.639218 Fe\n0.750000 0.360782 0.031533 Fe\n0.750000 0.968627 0.329309 Fe\n0.750000 0.670528 0.639163 Fe\n0.250000 0.329309 0.968627 Fe\n0.250000 0.639163 0.670528 Fe\n0.250000 0.031533 0.360782 Fe\n0.250000 0.639218 0.968467 Fe\n0.250000 0.031373 0.670691 Fe\n0.250000 0.329472 0.360837 Fe\n0.487172 0.834394 0.669010 Fe\n0.487153 0.834549 0.165451 Fe\n0.487172 0.330990 0.165606 Fe\n0.512828 0.165606 0.330990 Fe\n0.512847 0.165451 0.834549 Fe\n0.512828 0.669010 0.834394 Fe\n0.987172 0.165606 0.330990 Fe\n0.987153 0.165451 0.834549 Fe\n0.987172 0.669010 0.834394 Fe\n0.012828 0.834394 0.669010 Fe\n0.012847 0.834549 0.165451 Fe\n0.012828 0.330990 0.165606 Fe\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "Lu",
                "Fe"
            ],
            "chemical_system": "Fe-Lu",
            "density": 8.672194339862063,
            "density_atomic": 0.07637028317459478,
            "volume": 497.57573784459953,
            "volume_molar": 7.885450347529046,
            "formula_full": "Lu4 Fe34",
            "formula_reduced": "Lu2Fe17",
            "formula_anonymous": "A2B17",
            "energy": -307.13116066,
            "energy_per_atom": -8.082398964736841,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -307.13116066,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.1835048,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:29.332000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1104610",
            "created_at": "2022-09-04T14:45:12.260117Z",
            "structure_string": "Eu10 Pd4\n1.0\n3.444802 8.536897 0.000000\n-3.444802 8.536897 0.000000\n0.000000 0.991957 7.768287\nEu Pd\n10 4\ndirect\n0.016989 0.799131 0.420331 Eu\n0.200869 0.983011 0.079669 Eu\n0.983011 0.200869 0.579669 Eu\n0.799131 0.016989 0.920331 Eu\n0.360461 0.202412 0.317197 Eu\n0.797588 0.639539 0.182803 Eu\n0.639539 0.797588 0.682803 Eu\n0.202412 0.360461 0.817197 Eu\n0.585177 0.414823 0.250000 Eu\n0.414823 0.585177 0.750000 Eu\n0.185823 0.596003 0.079264 Pd\n0.403997 0.814177 0.420736 Pd\n0.814177 0.403997 0.920736 Pd\n0.596003 0.185823 0.579264 Pd\n",
            "nsites": 14,
            "nelements": 2,
            "elements": [
                "Eu",
                "Pd"
            ],
            "chemical_system": "Eu-Pd",
            "density": 7.070019069563954,
            "density_atomic": 0.030641390639337858,
            "volume": 456.89832308154445,
            "volume_molar": 19.65361439003584,
            "formula_full": "Eu10 Pd4",
            "formula_reduced": "Eu5Pd2",
            "formula_anonymous": "A2B5",
            "energy": -130.17286232,
            "energy_per_atom": -9.298061594285715,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -130.17286232,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.1994742,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:57.524000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1189619",
            "created_at": "2022-09-04T14:46:12.991728Z",
            "structure_string": "Eu10 Al10\n1.0\n5.754543 0.000000 0.000000\n0.000000 9.397358 0.000000\n0.000000 0.000000 9.980659\nEu Al\n10 10\ndirect\n0.500000 0.817646 0.914929 Eu\n0.500000 0.182354 0.914929 Eu\n0.000000 0.682354 0.085071 Eu\n0.000000 0.317646 0.085071 Eu\n0.500000 0.698632 0.310612 Eu\n0.500000 0.301368 0.310612 Eu\n0.000000 0.801368 0.689388 Eu\n0.000000 0.198632 0.689388 Eu\n0.500000 0.000000 0.506329 Eu\n0.000000 0.500000 0.493671 Eu\n0.740531 0.000000 0.183243 Al\n0.259469 0.000000 0.183243 Al\n0.759469 0.500000 0.816757 Al\n0.240531 0.500000 0.816757 Al\n0.500000 0.644402 0.627659 Al\n0.500000 0.355598 0.627659 Al\n0.000000 0.855598 0.372341 Al\n0.000000 0.144402 0.372341 Al\n0.500000 0.500000 0.045684 Al\n0.000000 0.000000 0.954316 Al\n",
            "nsites": 20,
            "nelements": 2,
            "elements": [
                "Eu",
                "Al"
            ],
            "chemical_system": "Al-Eu",
            "density": 5.505466741078382,
            "density_atomic": 0.03705562701939309,
            "volume": 539.7290940329517,
            "volume_molar": 16.251622882668556,
            "formula_full": "Eu10 Al10",
            "formula_reduced": "EuAl",
            "formula_anonymous": "AB",
            "energy": -146.0132929,
            "energy_per_atom": -7.300664645,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -146.0132929,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.2770215,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:28.510000Z",
            "spacegroup": 59
        },
        {
            "id": "mp-1197631",
            "created_at": "2022-09-04T14:42:52.806146Z",
            "structure_string": "La8 Co56 B4\n1.0\n8.629242 0.000000 0.000000\n0.000000 8.629242 0.000000\n0.000000 0.000000 11.880411\nLa Co B\n8 56 4\ndirect\n0.225173 0.774827 0.500000 La\n0.774827 0.225173 0.500000 La\n0.274827 0.274827 0.000000 La\n0.725173 0.725173 0.000000 La\n0.644505 0.644505 0.500000 La\n0.355495 0.355495 0.500000 La\n0.855495 0.144505 0.000000 La\n0.144505 0.855495 0.000000 La\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.115305 Co\n0.000000 0.000000 0.615305 Co\n0.500000 0.500000 0.884695 Co\n0.000000 0.000000 0.384695 Co\n0.182009 0.817991 0.252571 Co\n0.817991 0.182009 0.252571 Co\n0.317991 0.317991 0.752571 Co\n0.682009 0.682009 0.752571 Co\n0.817991 0.182009 0.747429 Co\n0.182009 0.817991 0.747429 Co\n0.682009 0.682009 0.247429 Co\n0.317991 0.317991 0.247429 Co\n0.400968 0.599032 0.291702 Co\n0.599032 0.400968 0.291702 Co\n0.099032 0.099032 0.791702 Co\n0.900968 0.900968 0.791702 Co\n0.599032 0.400968 0.708298 Co\n0.400968 0.599032 0.708298 Co\n0.900968 0.900968 0.208298 Co\n0.099032 0.099032 0.208298 Co\n0.139272 0.536064 0.320410 Co\n0.860728 0.463936 0.320410 Co\n0.360728 0.036064 0.820410 Co\n0.639272 0.963936 0.820410 Co\n0.860728 0.463936 0.679590 Co\n0.139272 0.536064 0.679590 Co\n0.639272 0.963936 0.179590 Co\n0.360728 0.036064 0.179590 Co\n0.536064 0.139272 0.320410 Co\n0.463936 0.860728 0.320410 Co\n0.036064 0.360728 0.820410 Co\n0.963936 0.639272 0.820410 Co\n0.463936 0.860728 0.679590 Co\n0.536064 0.139272 0.679590 Co\n0.963936 0.639272 0.179590 Co\n0.036064 0.360728 0.179590 Co\n0.929661 0.724085 0.373170 Co\n0.070339 0.275915 0.373170 Co\n0.570339 0.224085 0.873170 Co\n0.429661 0.775915 0.873170 Co\n0.070339 0.275915 0.626830 Co\n0.929661 0.724085 0.626830 Co\n0.429661 0.775915 0.126830 Co\n0.570339 0.224085 0.126830 Co\n0.724085 0.929661 0.373170 Co\n0.275915 0.070339 0.373170 Co\n0.224085 0.570339 0.873170 Co\n0.775915 0.429661 0.873170 Co\n0.275915 0.070339 0.626830 Co\n0.724085 0.929661 0.626830 Co\n0.775915 0.429661 0.126830 Co\n0.224085 0.570339 0.126830 Co\n0.878616 0.878616 0.500000 B\n0.121384 0.121384 0.500000 B\n0.621384 0.378616 0.000000 B\n0.378616 0.621384 0.000000 B\n",
            "nsites": 68,
            "nelements": 3,
            "elements": [
                "La",
                "Co",
                "B"
            ],
            "chemical_system": "B-Co-La",
            "density": 8.361714747594588,
            "density_atomic": 0.07686562278603301,
            "volume": 884.6607564644106,
            "volume_molar": 7.8346347062893535,
            "formula_full": "La8 Co56 B4",
            "formula_reduced": "La2Co14B",
            "formula_anonymous": "AB2C14",
            "energy": -471.45480491,
            "energy_per_atom": -6.9331588957352945,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -471.45480491,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.3979091,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:49.060000Z",
            "spacegroup": 136
        },
        {
            "id": "mp-5053",
            "created_at": "2022-09-04T14:42:43.701140Z",
            "structure_string": "K24 Cr24 F96\n1.0\n7.584264 0.000000 0.000000\n0.000000 16.076028 0.000000\n0.000000 0.000000 18.710525\nK Cr F\n24 24 96\ndirect\n0.750000 0.543199 0.968437 K\n0.250000 0.456801 0.031563 K\n0.750000 0.043199 0.531563 K\n0.250000 0.956801 0.468437 K\n0.250000 0.039320 0.023195 K\n0.750000 0.960680 0.976805 K\n0.250000 0.539320 0.476805 K\n0.750000 0.460680 0.523195 K\n0.250000 0.069803 0.679869 K\n0.750000 0.930197 0.320131 K\n0.250000 0.569803 0.820131 K\n0.750000 0.430197 0.179869 K\n0.250000 0.399104 0.665671 K\n0.750000 0.600896 0.334329 K\n0.250000 0.899104 0.834329 K\n0.750000 0.100896 0.165671 K\n0.250000 0.281878 0.210222 K\n0.750000 0.718122 0.789778 K\n0.250000 0.781878 0.289778 K\n0.750000 0.218122 0.710222 K\n0.750000 0.459422 0.714702 K\n0.250000 0.540578 0.285298 K\n0.750000 0.959422 0.785298 K\n0.250000 0.040578 0.214702 K\n0.499288 0.131807 0.868980 Cr\n0.999288 0.868193 0.131020 Cr\n0.000712 0.631807 0.631020 Cr\n0.500712 0.368193 0.368980 Cr\n0.500712 0.868193 0.131020 Cr\n0.000712 0.131807 0.868980 Cr\n0.999288 0.368193 0.368980 Cr\n0.499288 0.631807 0.631020 Cr\n0.497973 0.364057 0.873790 Cr\n0.997973 0.635943 0.126210 Cr\n0.002027 0.864057 0.626210 Cr\n0.502027 0.135943 0.373790 Cr\n0.502027 0.635943 0.126210 Cr\n0.002027 0.364057 0.873790 Cr\n0.997973 0.135943 0.373790 Cr\n0.497973 0.864057 0.626210 Cr\n0.499046 0.247225 0.046973 Cr\n0.999046 0.752775 0.953027 Cr\n0.000954 0.747225 0.453027 Cr\n0.500954 0.252775 0.546973 Cr\n0.500954 0.752775 0.953027 Cr\n0.000954 0.247225 0.046973 Cr\n0.999046 0.252775 0.546973 Cr\n0.499046 0.747225 0.453027 Cr\n0.541047 0.096897 0.773540 F\n0.041047 0.903103 0.226460 F\n0.958953 0.596897 0.726460 F\n0.458953 0.403103 0.273540 F\n0.458953 0.903103 0.226460 F\n0.958953 0.096897 0.773540 F\n0.041047 0.403103 0.273540 F\n0.541047 0.596897 0.726460 F\n0.458420 0.163645 0.969963 F\n0.958420 0.836355 0.030037 F\n0.041580 0.663645 0.530037 F\n0.541580 0.336355 0.469963 F\n0.541580 0.836355 0.030037 F\n0.041580 0.163645 0.969963 F\n0.958420 0.336355 0.469963 F\n0.458420 0.663645 0.530037 F\n0.461496 0.019355 0.899114 F\n0.961496 0.980645 0.100886 F\n0.038504 0.519355 0.600886 F\n0.538504 0.480645 0.399114 F\n0.538504 0.980645 0.100886 F\n0.038504 0.019355 0.899114 F\n0.961496 0.480645 0.399114 F\n0.461496 0.519355 0.600886 F\n0.548813 0.248369 0.840050 F\n0.048813 0.751631 0.159950 F\n0.951187 0.748369 0.659950 F\n0.451187 0.251631 0.340050 F\n0.451187 0.751631 0.159950 F\n0.951187 0.248369 0.840050 F\n0.048813 0.251631 0.340050 F\n0.548813 0.748369 0.659950 F\n0.460308 0.399001 0.778019 F\n0.960308 0.600999 0.221981 F\n0.039692 0.899001 0.721981 F\n0.539692 0.100999 0.278019 F\n0.539692 0.600999 0.221981 F\n0.039692 0.399001 0.778019 F\n0.960308 0.100999 0.278019 F\n0.460308 0.899001 0.721981 F\n0.750000 0.113903 0.893607 F\n0.250000 0.886097 0.106393 F\n0.750000 0.613903 0.606393 F\n0.250000 0.386097 0.393607 F\n0.750000 0.393790 0.859665 F\n0.250000 0.606210 0.140335 F\n0.750000 0.893790 0.640335 F\n0.250000 0.106210 0.359665 F\n0.250000 0.147719 0.845193 F\n0.750000 0.852281 0.154807 F\n0.250000 0.647719 0.654807 F\n0.750000 0.352281 0.345193 F\n0.250000 0.333511 0.888808 F\n0.750000 0.666489 0.111192 F\n0.250000 0.833511 0.611192 F\n0.750000 0.166489 0.388808 F\n0.457441 0.473238 0.909353 F\n0.957441 0.526762 0.090647 F\n0.042559 0.973238 0.590647 F\n0.542559 0.026762 0.409353 F\n0.542559 0.526762 0.090647 F\n0.042559 0.473238 0.909353 F\n0.957441 0.026762 0.409353 F\n0.457441 0.973238 0.590647 F\n0.250000 0.281208 0.039155 F\n0.750000 0.718792 0.960845 F\n0.250000 0.781208 0.460845 F\n0.750000 0.218792 0.539155 F\n0.442115 0.163734 0.115778 F\n0.942115 0.836266 0.884222 F\n0.057885 0.663734 0.384222 F\n0.557885 0.336266 0.615778 F\n0.557885 0.836266 0.884222 F\n0.057885 0.163734 0.115778 F\n0.942115 0.336266 0.615778 F\n0.442115 0.663734 0.384222 F\n0.552032 0.331977 0.973719 F\n0.052032 0.668023 0.026281 F\n0.947968 0.831977 0.526281 F\n0.447968 0.168023 0.473719 F\n0.447968 0.668023 0.026281 F\n0.947968 0.331977 0.973719 F\n0.052032 0.168023 0.473719 F\n0.552032 0.831977 0.526281 F\n0.519631 0.327882 0.119806 F\n0.019631 0.672118 0.880194 F\n0.980369 0.827882 0.380194 F\n0.480369 0.172118 0.619806 F\n0.480369 0.672118 0.880194 F\n0.980369 0.327882 0.119806 F\n0.019631 0.172118 0.619806 F\n0.519631 0.827882 0.380194 F\n0.750000 0.213276 0.052468 F\n0.250000 0.786724 0.947532 F\n0.750000 0.713276 0.447532 F\n0.250000 0.286724 0.552468 F\n",
            "nsites": 144,
            "nelements": 3,
            "elements": [
                "K",
                "Cr",
                "F"
            ],
            "chemical_system": "Cr-F-K",
            "density": 2.9189554296864553,
            "density_atomic": 0.06312251913673902,
            "volume": 2281.277774862887,
            "volume_molar": 9.540399911724926,
            "formula_full": "K24 Cr24 F96",
            "formula_reduced": "KCrF4",
            "formula_anonymous": "ABC4",
            "energy": -889.23746838,
            "energy_per_atom": -6.175260197083333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -796.90946838,
            "band_gap": 2.9232,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 72.4096593,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:00.497000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1219321",
            "created_at": "2022-09-04T14:43:02.796778Z",
            "structure_string": "Sm4 Cr1 Fe33\n1.0\n4.267876 2.458256 4.151946\n-4.267876 2.458256 4.151946\n0.000000 -9.827708 8.300781\nSm Cr Fe\n4 1 33\ndirect\n0.655224 0.655224 0.327528 Sm\n0.659944 0.659944 0.830032 Sm\n0.340876 0.340876 0.170748 Sm\n0.340424 0.340424 0.669855 Sm\n0.908444 0.908444 0.454144 Cr\n0.292080 0.707991 0.000163 Fe\n0.295065 0.706057 0.500110 Fe\n0.708048 0.999573 0.146161 Fe\n0.707046 0.000605 0.647171 Fe\n0.000850 0.294216 0.353608 Fe\n0.999736 0.292248 0.853614 Fe\n0.294216 0.000850 0.353608 Fe\n0.292248 0.999736 0.853614 Fe\n0.999573 0.708048 0.146161 Fe\n0.000605 0.707046 0.647171 Fe\n0.707991 0.292080 0.000163 Fe\n0.706057 0.295065 0.500110 Fe\n0.998494 0.998494 0.250884 Fe\n0.000076 0.000076 0.749863 Fe\n0.998577 0.501518 0.499198 Fe\n0.000006 0.499983 0.000189 Fe\n0.499983 0.000006 0.000189 Fe\n0.501518 0.998577 0.499198 Fe\n0.843862 0.340604 0.171748 Fe\n0.844266 0.343081 0.670013 Fe\n0.341426 0.341426 0.421890 Fe\n0.342096 0.342096 0.922060 Fe\n0.340604 0.843862 0.171748 Fe\n0.343081 0.844266 0.670013 Fe\n0.155479 0.658314 0.329336 Fe\n0.156254 0.658241 0.828740 Fe\n0.657802 0.657802 0.078146 Fe\n0.658645 0.658645 0.578113 Fe\n0.658314 0.155479 0.329336 Fe\n0.658241 0.156254 0.828740 Fe\n0.903997 0.903997 0.952050 Fe\n0.096053 0.096053 0.047859 Fe\n0.092801 0.092801 0.546729 Fe\n",
            "nsites": 38,
            "nelements": 3,
            "elements": [
                "Sm",
                "Cr",
                "Fe"
            ],
            "chemical_system": "Cr-Fe-Sm",
            "density": 7.933932766130471,
            "density_atomic": 0.07273150384187206,
            "volume": 522.4696038544321,
            "volume_molar": 8.279961834823233,
            "formula_full": "Sm4 Cr1 Fe33",
            "formula_reduced": "Sm4CrFe33",
            "formula_anonymous": "AB4C33",
            "energy": -307.0869025299999,
            "energy_per_atom": -8.081234277105262,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -307.0869025299999,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.5034994,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:08.650000Z",
            "spacegroup": 8
        },
        {
            "id": "mp-1189588",
            "created_at": "2022-09-04T14:42:53.290850Z",
            "structure_string": "Eu10 Cd2 Cu4\n1.0\n-4.061937 4.061937 7.443750\n4.061937 -4.061937 7.443750\n4.061937 4.061937 -7.443750\nEu Cd Cu\n10 2 4\ndirect\n0.500000 0.500000 0.000000 Eu\n0.000000 0.000000 0.000000 Eu\n0.526699 0.026699 0.833404 Eu\n0.193295 0.693295 0.166596 Eu\n0.026699 0.193295 0.500000 Eu\n0.693295 0.526699 0.500000 Eu\n0.473301 0.973301 0.166596 Eu\n0.806705 0.306705 0.833404 Eu\n0.973301 0.806705 0.500000 Eu\n0.306705 0.473301 0.500000 Eu\n0.250000 0.250000 0.000000 Cd\n0.750000 0.750000 0.000000 Cd\n0.115019 0.615019 0.730037 Cu\n0.884981 0.384981 0.269963 Cu\n0.615019 0.884981 0.500000 Cu\n0.384981 0.115019 0.500000 Cu\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Eu",
                "Cd",
                "Cu"
            ],
            "chemical_system": "Cd-Cu-Eu",
            "density": 6.7556453043234255,
            "density_atomic": 0.032568806651165266,
            "volume": 491.267616015877,
            "volume_molar": 18.49051709048276,
            "formula_full": "Eu10 Cd2 Cu4",
            "formula_reduced": "Eu5CdCu2",
            "formula_anonymous": "AB2C5",
            "energy": -123.67023831,
            "energy_per_atom": -7.729389894375,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -123.67023831,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.7057741,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:54.553000Z",
            "spacegroup": 140
        },
        {
            "id": "mp-1197003",
            "created_at": "2022-09-04T14:42:38.318667Z",
            "structure_string": "Pr8 Co56 B4\n1.0\n8.618583 0.000000 0.000000\n0.000000 8.618583 0.000000\n0.000000 0.000000 11.828713\nPr Co B\n8 56 4\ndirect\n0.225287 0.774713 0.500000 Pr\n0.774713 0.225287 0.500000 Pr\n0.274713 0.274713 0.000000 Pr\n0.725287 0.725287 0.000000 Pr\n0.644554 0.644554 0.500000 Pr\n0.355446 0.355446 0.500000 Pr\n0.855446 0.144554 0.000000 Pr\n0.144554 0.855446 0.000000 Pr\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.116047 Co\n0.000000 0.000000 0.616047 Co\n0.500000 0.500000 0.883953 Co\n0.000000 0.000000 0.383953 Co\n0.182041 0.817959 0.253140 Co\n0.817959 0.182041 0.253140 Co\n0.317959 0.317959 0.753140 Co\n0.682041 0.682041 0.753140 Co\n0.817959 0.182041 0.746860 Co\n0.182041 0.817959 0.746860 Co\n0.682041 0.682041 0.246860 Co\n0.317959 0.317959 0.246860 Co\n0.401201 0.598799 0.293375 Co\n0.598799 0.401201 0.293375 Co\n0.098799 0.098799 0.793375 Co\n0.901201 0.901201 0.793375 Co\n0.598799 0.401201 0.706625 Co\n0.401201 0.598799 0.706625 Co\n0.901201 0.901201 0.206625 Co\n0.098799 0.098799 0.206625 Co\n0.139366 0.536309 0.320514 Co\n0.860634 0.463691 0.320514 Co\n0.360634 0.036309 0.820514 Co\n0.639366 0.963691 0.820514 Co\n0.860634 0.463691 0.679486 Co\n0.139366 0.536309 0.679486 Co\n0.639366 0.963691 0.179486 Co\n0.360634 0.036309 0.179486 Co\n0.536309 0.139366 0.320514 Co\n0.463691 0.860634 0.320514 Co\n0.036309 0.360634 0.820514 Co\n0.963691 0.639366 0.820514 Co\n0.463691 0.860634 0.679486 Co\n0.536309 0.139366 0.679486 Co\n0.963691 0.639366 0.179486 Co\n0.036309 0.360634 0.179486 Co\n0.930493 0.724470 0.372840 Co\n0.069507 0.275530 0.372840 Co\n0.569507 0.224470 0.872840 Co\n0.430493 0.775530 0.872840 Co\n0.069507 0.275530 0.627160 Co\n0.930493 0.724470 0.627160 Co\n0.430493 0.775530 0.127160 Co\n0.569507 0.224470 0.127160 Co\n0.724470 0.930493 0.372840 Co\n0.275530 0.069507 0.372840 Co\n0.224470 0.569507 0.872840 Co\n0.775530 0.430493 0.872840 Co\n0.275530 0.069507 0.627160 Co\n0.724470 0.930493 0.627160 Co\n0.775530 0.430493 0.127160 Co\n0.224470 0.569507 0.127160 Co\n0.877952 0.877952 0.500000 B\n0.122048 0.122048 0.500000 B\n0.622048 0.377952 0.000000 B\n0.377952 0.622048 0.000000 B\n",
            "nsites": 68,
            "nelements": 3,
            "elements": [
                "Pr",
                "Co",
                "B"
            ],
            "chemical_system": "B-Co-Pr",
            "density": 8.44931736374648,
            "density_atomic": 0.0773926435318728,
            "volume": 878.6364814117686,
            "volume_molar": 7.781283188136463,
            "formula_full": "Pr8 Co56 B4",
            "formula_reduced": "Pr2Co14B",
            "formula_anonymous": "AB2C14",
            "energy": -470.17484,
            "energy_per_atom": -6.914335882352941,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -470.17484,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 72.7237315,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:53.338000Z",
            "spacegroup": 136
        }
    ]
}