GET /third-parties/MatprojStructure/?format=api&ordering=is_theoretical&page=95
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=is_theoretical&page=96",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=is_theoretical&page=94",
    "results": [
        {
            "id": "mp-1095677",
            "created_at": "2022-09-04T14:39:59.158194Z",
            "structure_string": "Np4 Sb8\n1.0\n3.065460 -3.087307 0.000000\n3.065460 3.087307 0.000000\n0.000000 0.000000 17.247987\nNp Sb\n4 8\ndirect\n0.360665 0.360665 0.892317 Np\n0.639335 0.639335 0.107683 Np\n0.139335 0.139335 0.392317 Np\n0.860665 0.860665 0.607683 Np\n0.359834 0.359834 0.569485 Sb\n0.640166 0.640166 0.430515 Sb\n0.140166 0.140166 0.069485 Sb\n0.859834 0.859834 0.930515 Sb\n0.372389 0.872389 0.750000 Sb\n0.127611 0.627611 0.250000 Sb\n0.627611 0.127611 0.250000 Sb\n0.872389 0.372389 0.750000 Sb\n",
            "nsites": 12,
            "nelements": 2,
            "elements": [
                "Np",
                "Sb"
            ],
            "chemical_system": "Np-Sb",
            "density": 9.776348490932005,
            "density_atomic": 0.0367567718835128,
            "volume": 326.4704538807061,
            "volume_molar": 16.383758560422503,
            "formula_full": "Np4 Sb8",
            "formula_reduced": "NpSb2",
            "formula_anonymous": "AB2",
            "energy": -89.22648811,
            "energy_per_atom": -7.435540675833334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -87.69048811,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 15.479128,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:44.642000Z",
            "spacegroup": 64
        },
        {
            "id": "mp-1193677",
            "created_at": "2022-09-04T14:39:42.631953Z",
            "structure_string": "Hg6 As4 H4 O16\n1.0\n-5.423563 -4.356312 4.019043\n5.423563 -4.356312 -4.019043\n5.334139 4.356312 5.633350\nHg As H O\n6 4 4 16\ndirect\n0.194130 0.419641 0.918698 Hg\n0.000943 0.275431 0.581302 Hg\n0.805870 0.580359 0.081302 Hg\n0.999057 0.724569 0.418698 Hg\n0.514439 0.764439 0.750000 Hg\n0.485561 0.235561 0.250000 Hg\n0.505937 0.270714 0.632109 As\n0.138605 0.873828 0.867891 As\n0.494063 0.729286 0.367891 As\n0.861395 0.126172 0.132109 As\n0.722291 0.191075 0.827542 H\n0.863534 0.894749 0.672458 H\n0.277709 0.808925 0.172458 H\n0.136466 0.105251 0.327542 H\n0.610018 0.126013 0.697474 O\n0.928539 0.912544 0.802526 O\n0.389982 0.873987 0.302526 O\n0.071461 0.087456 0.197474 O\n0.627936 0.378588 0.518110 O\n0.360478 0.109826 0.981890 O\n0.372064 0.621412 0.481890 O\n0.639522 0.890174 0.018110 O\n0.887298 0.269041 0.011870 O\n0.757171 0.875428 0.488130 O\n0.112702 0.730959 0.988130 O\n0.242829 0.124572 0.511870 O\n0.573854 0.462159 0.808290 O\n0.153869 0.765564 0.691710 O\n0.426146 0.537841 0.191710 O\n0.846131 0.234436 0.308290 O\n",
            "nsites": 30,
            "nelements": 4,
            "elements": [
                "Hg",
                "As",
                "H",
                "O"
            ],
            "chemical_system": "As-H-Hg-O",
            "density": 6.463768659882407,
            "density_atomic": 0.06622842452230385,
            "volume": 452.9777088370395,
            "volume_molar": 9.092985079196493,
            "formula_full": "Hg6 As4 H4 O16",
            "formula_reduced": "Hg3As2(HO4)2",
            "formula_anonymous": "A2B2C3D8",
            "energy": -150.64645012999998,
            "energy_per_atom": -5.021548337666666,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -139.65445013,
            "band_gap": 2.4844,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004032,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:25.547000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-644802",
            "created_at": "2022-09-04T14:39:59.915506Z",
            "structure_string": "C136 F40\n1.0\n19.970943 0.000000 0.000000\n0.000000 9.951921 0.000000\n0.000000 3.415914 9.824505\nC F\n136 40\ndirect\n0.286971 0.570526 0.789924 C\n0.786326 0.257132 0.913738 C\n0.320133 0.323248 0.617538 C\n0.321487 0.989361 0.261231 C\n0.321515 0.849253 0.119071 C\n0.379094 0.412968 0.584913 C\n0.213932 0.289458 0.514430 C\n0.122908 0.756552 0.674560 C\n0.250000 0.505826 0.172228 C\n0.879871 0.100852 0.706098 C\n0.620906 0.587032 0.415087 C\n0.808748 0.403775 0.860516 C\n0.576503 0.304744 0.517069 C\n0.786448 0.983578 0.633342 C\n0.250000 0.920853 0.592144 C\n0.171942 0.444690 0.785026 C\n0.596197 0.363220 0.376608 C\n0.377092 0.756552 0.674560 C\n0.861122 0.643678 0.078860 C\n0.713674 0.257132 0.913738 C\n0.098303 0.466460 0.449815 C\n0.880257 0.187657 0.793811 C\n0.213552 0.016422 0.366658 C\n0.075654 0.611773 0.397499 C\n0.828058 0.555310 0.214974 C\n0.634451 0.439175 0.776734 C\n0.309627 0.958983 0.505306 C\n0.998718 0.774770 0.751500 C\n0.881681 0.502431 0.327092 C\n0.865310 0.565701 0.657301 C\n0.714909 0.040812 0.847171 C\n0.190373 0.958983 0.505306 C\n0.809100 0.290372 0.260226 C\n0.713029 0.429474 0.210076 C\n0.786971 0.429474 0.210076 C\n0.690900 0.290372 0.260226 C\n0.424346 0.611773 0.397499 C\n0.380257 0.812343 0.206189 C\n0.178513 0.989361 0.261231 C\n0.365310 0.434299 0.342699 C\n0.634690 0.565701 0.657301 C\n0.618319 0.502431 0.327092 C\n0.750000 0.079147 0.407856 C\n0.381681 0.497569 0.672908 C\n0.865549 0.439175 0.776734 C\n0.213674 0.742868 0.086262 C\n0.584945 0.045702 0.222584 C\n0.179867 0.323248 0.617538 C\n0.619743 0.187657 0.793811 C\n0.132556 0.876862 0.536196 C\n0.365549 0.560825 0.223266 C\n0.638878 0.643678 0.078860 C\n0.401697 0.466460 0.449815 C\n0.679867 0.676752 0.382462 C\n0.903803 0.363220 0.376608 C\n0.713552 0.983578 0.633342 C\n0.001282 0.225230 0.248500 C\n0.691252 0.403775 0.860516 C\n0.879094 0.587032 0.415087 C\n0.620129 0.100852 0.706098 C\n0.134690 0.434299 0.342699 C\n0.308748 0.596225 0.139484 C\n0.361122 0.356322 0.921140 C\n0.119743 0.812343 0.206189 C\n0.097921 0.670796 0.256962 C\n0.118319 0.497569 0.672908 C\n0.403803 0.636780 0.623392 C\n0.286326 0.742868 0.086262 C\n0.808726 0.653057 0.625687 C\n0.902079 0.329204 0.743038 C\n0.074006 0.799468 0.775414 C\n0.076503 0.695256 0.482931 C\n0.084945 0.954298 0.777416 C\n0.191274 0.346943 0.374313 C\n0.867444 0.123138 0.463804 C\n0.134451 0.560825 0.223266 C\n0.098774 0.842232 0.430093 C\n0.308726 0.346943 0.374313 C\n0.574006 0.200532 0.224586 C\n0.367444 0.876862 0.536196 C\n0.215355 0.350761 0.726315 C\n0.690373 0.041017 0.494694 C\n0.286068 0.289458 0.514430 C\n0.820133 0.676752 0.382462 C\n0.915055 0.045702 0.222584 C\n0.901697 0.533540 0.550185 C\n0.671942 0.555310 0.214974 C\n0.715355 0.649239 0.273685 C\n0.924346 0.388227 0.602501 C\n0.678485 0.150747 0.880929 C\n0.309100 0.709628 0.739774 C\n0.286448 0.016422 0.366658 C\n0.821487 0.010639 0.738769 C\n0.190900 0.709628 0.739774 C\n0.785091 0.040812 0.847171 C\n0.402079 0.670796 0.256962 C\n0.901226 0.157768 0.569907 C\n0.786068 0.710542 0.485570 C\n0.622908 0.243448 0.325440 C\n0.877092 0.243448 0.325440 C\n0.713932 0.710542 0.485570 C\n0.598774 0.157768 0.569907 C\n0.178485 0.849253 0.119071 C\n0.250000 0.799538 0.704900 C\n0.678513 0.010639 0.738769 C\n0.284645 0.350761 0.726315 C\n0.498718 0.225230 0.248500 C\n0.096197 0.636780 0.623392 C\n0.501282 0.774770 0.751500 C\n0.191252 0.596225 0.139484 C\n0.750000 0.494174 0.827772 C\n0.328058 0.444690 0.785026 C\n0.213029 0.570526 0.789924 C\n0.821515 0.150747 0.880929 C\n0.575654 0.388227 0.602501 C\n0.784645 0.649239 0.273685 C\n0.750000 0.200462 0.295100 C\n0.598303 0.533540 0.550185 C\n0.138878 0.356322 0.921140 C\n0.285091 0.959188 0.152829 C\n0.415055 0.954298 0.777416 C\n0.809627 0.041017 0.494694 C\n0.597921 0.329204 0.743038 C\n0.425994 0.799468 0.775414 C\n0.120906 0.412968 0.584913 C\n0.925994 0.200532 0.224586 C\n0.750000 0.616850 0.712302 C\n0.214909 0.959188 0.152829 C\n0.632556 0.123138 0.463804 C\n0.423497 0.695256 0.482931 C\n0.379871 0.899148 0.293902 C\n0.923497 0.304744 0.517069 C\n0.691274 0.653057 0.625687 C\n0.120129 0.899148 0.293902 C\n0.250000 0.383150 0.287698 C\n0.401226 0.842232 0.430093 C\n0.481114 0.160650 0.380530 F\n0.586521 0.287710 0.092064 F\n0.055661 0.972745 0.887413 F\n0.981114 0.839350 0.619470 F\n0.513147 0.633728 0.785053 F\n0.315786 0.308329 0.023250 F\n0.392763 0.240037 0.907773 F\n0.059026 0.051878 0.664241 F\n0.413479 0.712290 0.907936 F\n0.086521 0.712290 0.907936 F\n0.986853 0.633728 0.785053 F\n0.444339 0.972745 0.887413 F\n0.518886 0.839350 0.619470 F\n0.184214 0.308329 0.023250 F\n0.151186 0.981637 0.783308 F\n0.013147 0.366272 0.214947 F\n0.848814 0.018363 0.216692 F\n0.486853 0.366272 0.214947 F\n0.913479 0.287710 0.092064 F\n0.348814 0.981637 0.783308 F\n0.018886 0.160650 0.380530 F\n0.958449 0.825439 0.829634 F\n0.684214 0.691671 0.976750 F\n0.944339 0.027255 0.112587 F\n0.559026 0.948122 0.335759 F\n0.607237 0.759963 0.092227 F\n0.458449 0.174561 0.170366 F\n0.407522 0.433189 0.961855 F\n0.041551 0.174561 0.170366 F\n0.592478 0.566811 0.038145 F\n0.907522 0.566811 0.038145 F\n0.107237 0.240037 0.907773 F\n0.892763 0.759963 0.092227 F\n0.440974 0.051878 0.664241 F\n0.940974 0.948122 0.335759 F\n0.555661 0.027255 0.112587 F\n0.815786 0.691671 0.976750 F\n0.541551 0.825439 0.829634 F\n0.092478 0.433189 0.961855 F\n0.651186 0.018363 0.216692 F\n",
            "nsites": 176,
            "nelements": 2,
            "elements": [
                "C",
                "F"
            ],
            "chemical_system": "C-F",
            "density": 2.0353853325825564,
            "density_atomic": 0.09013562984331963,
            "volume": 1952.6129712072363,
            "volume_molar": 6.681198955915797,
            "formula_full": "C136 F40",
            "formula_reduced": "C17F5",
            "formula_anonymous": "A5B17",
            "energy": -1387.90325794,
            "energy_per_atom": -7.885813965568182,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -1369.42325794,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0927543,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:54.285000Z",
            "spacegroup": 11
        },
        {
            "id": "mp-1198646",
            "created_at": "2022-09-04T14:39:59.917821Z",
            "structure_string": "Cs8 Ba2 V12 O36\n1.0\n7.950843 -7.113424 0.000000\n7.950843 7.113424 0.000000\n1.586637 0.000000 10.549848\nCs Ba V O\n8 2 12 36\ndirect\n0.499155 0.499155 0.499155 Cs\n0.999155 0.999155 0.999155 Cs\n0.907639 0.088614 0.487020 Cs\n0.487020 0.907639 0.088614 Cs\n0.088614 0.487020 0.907639 Cs\n0.987020 0.588614 0.407639 Cs\n0.407639 0.987020 0.588614 Cs\n0.588614 0.407639 0.987020 Cs\n0.268644 0.268644 0.268644 Ba\n0.768644 0.768644 0.768644 Ba\n0.800188 0.669071 0.103070 V\n0.103070 0.800188 0.669071 V\n0.669071 0.103070 0.800188 V\n0.603070 0.169071 0.300188 V\n0.300188 0.603070 0.169071 V\n0.169071 0.300188 0.603070 V\n0.690899 0.834780 0.376411 V\n0.376411 0.690899 0.834780 V\n0.834780 0.376411 0.690899 V\n0.876411 0.334780 0.190899 V\n0.190899 0.876411 0.334780 V\n0.334780 0.190899 0.876411 V\n0.007952 0.350060 0.665530 O\n0.665530 0.007952 0.350060 O\n0.350060 0.665530 0.007952 O\n0.165530 0.850060 0.507952 O\n0.507952 0.165530 0.850060 O\n0.850060 0.507952 0.165530 O\n0.170931 0.170239 0.527107 O\n0.527107 0.170931 0.170239 O\n0.170239 0.527107 0.170931 O\n0.027107 0.670239 0.670931 O\n0.670931 0.027107 0.670239 O\n0.670239 0.670931 0.027107 O\n0.770780 0.770054 0.233011 O\n0.233011 0.770780 0.770054 O\n0.770054 0.233011 0.770780 O\n0.733011 0.270054 0.270780 O\n0.270780 0.733011 0.270054 O\n0.270054 0.270780 0.733011 O\n0.910995 0.722832 0.991380 O\n0.991380 0.910995 0.722832 O\n0.722832 0.991380 0.910995 O\n0.491380 0.222832 0.410995 O\n0.410995 0.491380 0.222832 O\n0.222832 0.410995 0.491380 O\n0.000165 0.292236 0.277940 O\n0.277940 0.000165 0.292236 O\n0.292236 0.277940 0.000165 O\n0.777940 0.792236 0.500165 O\n0.500165 0.777940 0.792236 O\n0.792236 0.500165 0.777940 O\n0.549898 0.779500 0.410800 O\n0.410800 0.549898 0.779500 O\n0.779500 0.410800 0.549898 O\n0.910800 0.279500 0.049898 O\n0.049898 0.910800 0.279500 O\n0.279500 0.049898 0.910800 O\n",
            "nsites": 58,
            "nelements": 4,
            "elements": [
                "Cs",
                "Ba",
                "V",
                "O"
            ],
            "chemical_system": "Ba-Cs-O-V",
            "density": 3.5137619638402167,
            "density_atomic": 0.048602646920669866,
            "volume": 1193.3506439406206,
            "volume_molar": 12.390561299736309,
            "formula_full": "Cs8 Ba2 V12 O36",
            "formula_reduced": "Cs4BaV6O18",
            "formula_anonymous": "AB4C6D18",
            "energy": -444.23825601,
            "energy_per_atom": -7.659280276034482,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -399.10625601,
            "band_gap": 3.0382,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0008752,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:43.056000Z",
            "spacegroup": 161
        },
        {
            "id": "mp-1095528",
            "created_at": "2022-09-04T14:40:05.089890Z",
            "structure_string": "Ho1 Ge4 Rh6\n1.0\n3.613784 -6.259257 0.000000\n3.613784 6.259257 0.000000\n0.000000 0.000000 3.843236\nHo Ge Rh\n1 4 6\ndirect\n0.000000 0.000000 0.000000 Ho\n0.803650 0.196350 0.500000 Ge\n0.803650 0.607300 0.500000 Ge\n0.392700 0.196350 0.500000 Ge\n0.333333 0.666667 0.000000 Ge\n0.533517 0.466483 0.000000 Rh\n0.533517 0.067034 0.000000 Rh\n0.932966 0.466483 0.000000 Rh\n0.198336 0.801664 0.500000 Rh\n0.198336 0.396672 0.500000 Rh\n0.603328 0.801664 0.500000 Rh\n",
            "nsites": 11,
            "nelements": 3,
            "elements": [
                "Ho",
                "Ge",
                "Rh"
            ],
            "chemical_system": "Ge-Ho-Rh",
            "density": 10.2472128758603,
            "density_atomic": 0.06326749817795453,
            "volume": 173.86494356169965,
            "volume_molar": 9.518537848709192,
            "formula_full": "Ho1 Ge4 Rh6",
            "formula_reduced": "Ho(Ge2Rh3)2",
            "formula_anonymous": "AB4C6",
            "energy": -75.37812352,
            "energy_per_atom": -6.852556683636364,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -75.37812352,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0173188,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:45.888000Z",
            "spacegroup": 187
        },
        {
            "id": "mp-18371",
            "created_at": "2022-09-04T14:39:46.661368Z",
            "structure_string": "Cs4 W6 Se2 O24\n1.0\n7.360128 0.000000 0.000000\n-3.680064 6.374058 0.000000\n0.000000 0.000000 13.162431\nCs W Se O\n4 6 2 24\ndirect\n0.666667 0.333333 0.221298 Cs\n0.333333 0.666667 0.094631 Cs\n0.333333 0.666667 0.721298 Cs\n0.666667 0.333333 0.594631 Cs\n0.812392 0.661585 0.894572 W\n0.150807 0.812392 0.394572 W\n0.187608 0.338415 0.394572 W\n0.661585 0.849193 0.394572 W\n0.849193 0.187608 0.894572 W\n0.338415 0.150807 0.894572 W\n0.000000 0.000000 0.676868 Se\n0.000000 0.000000 0.176868 Se\n0.877165 0.126528 0.731688 O\n0.750637 0.877165 0.231688 O\n0.126528 0.249363 0.231688 O\n0.873472 0.750637 0.731688 O\n0.249363 0.122835 0.731688 O\n0.122835 0.873472 0.231688 O\n0.910347 0.459033 0.855011 O\n0.451314 0.910347 0.355011 O\n0.459033 0.548686 0.355011 O\n0.540967 0.451314 0.855011 O\n0.548686 0.089653 0.855011 O\n0.089653 0.540967 0.355011 O\n0.872286 0.752346 0.402019 O\n0.119940 0.872286 0.902019 O\n0.752346 0.880060 0.902019 O\n0.247654 0.119940 0.402019 O\n0.880060 0.127714 0.402019 O\n0.127714 0.247654 0.902019 O\n0.191130 0.796667 0.524711 O\n0.394463 0.191130 0.024711 O\n0.796667 0.605537 0.024711 O\n0.203333 0.394463 0.524711 O\n0.605537 0.808870 0.524711 O\n0.808870 0.203333 0.024711 O\n",
            "nsites": 36,
            "nelements": 4,
            "elements": [
                "Cs",
                "W",
                "Se",
                "O"
            ],
            "chemical_system": "Cs-O-Se-W",
            "density": 5.853070206085689,
            "density_atomic": 0.0582995248269968,
            "volume": 617.500744763008,
            "volume_molar": 10.329656678799076,
            "formula_full": "Cs4 W6 Se2 O24",
            "formula_reduced": "Cs2W3SeO12",
            "formula_anonymous": "AB2C3D12",
            "energy": -283.18400905,
            "energy_per_atom": -7.866222473611111,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -240.06800905,
            "band_gap": 2.443,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.1454119,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:32.640000Z",
            "spacegroup": 173
        },
        {
            "id": "mp-1189210",
            "created_at": "2022-09-04T14:40:05.197174Z",
            "structure_string": "Tm10 Sn6\n1.0\n0.000000 0.000000 -6.462678\n-4.418583 -7.653211 0.000000\n-4.421318 7.654789 0.000000\nTm Sn\n10 6\ndirect\n0.500000 0.333368 0.666761 Tm\n0.500000 0.666607 0.333239 Tm\n0.000000 0.666632 0.333239 Tm\n0.000000 0.333393 0.666761 Tm\n0.750003 0.239340 0.000000 Tm\n0.749998 0.760579 0.760663 Tm\n0.749998 0.999916 0.239337 Tm\n0.250003 0.760660 0.000000 Tm\n0.249998 0.239421 0.239337 Tm\n0.249998 0.000084 0.760663 Tm\n0.749997 0.605305 0.000000 Sn\n0.750002 0.394596 0.394560 Sn\n0.750002 0.000036 0.605440 Sn\n0.249997 0.394695 0.000000 Sn\n0.250002 0.605404 0.605440 Sn\n0.250002 0.999964 0.394560 Sn\n",
            "nsites": 16,
            "nelements": 2,
            "elements": [
                "Tm",
                "Sn"
            ],
            "chemical_system": "Sn-Tm",
            "density": 9.120145959470456,
            "density_atomic": 0.03659077595820323,
            "volume": 437.26867170776643,
            "volume_molar": 16.458084318514995,
            "formula_full": "Tm10 Sn6",
            "formula_reduced": "Tm5Sn3",
            "formula_anonymous": "A3B5",
            "energy": -79.9528787,
            "energy_per_atom": -4.99705491875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -79.9528787,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0078277,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:50.031000Z",
            "spacegroup": 193
        },
        {
            "id": "mp-20486",
            "created_at": "2022-09-04T14:39:48.226065Z",
            "structure_string": "Pu3 Ga1\n1.0\n4.131532 0.000000 0.000000\n0.000000 4.131532 0.000000\n0.000000 0.000000 4.131532\nPu Ga\n3 1\ndirect\n0.000000 0.500000 0.500000 Pu\n0.500000 0.500000 0.000000 Pu\n0.500000 0.000000 0.500000 Pu\n0.000000 0.000000 0.000000 Ga\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Pu",
                "Ga"
            ],
            "chemical_system": "Ga-Pu",
            "density": 18.87730869724272,
            "density_atomic": 0.056718747090480824,
            "volume": 70.523419595623,
            "volume_molar": 10.6175489920346,
            "formula_full": "Pu3 Ga1",
            "formula_reduced": "Pu3Ga",
            "formula_anonymous": "AB3",
            "energy": -44.66753251,
            "energy_per_atom": -11.1668831275,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -44.66753251,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 11.8830165,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:43.471000Z",
            "spacegroup": 221
        },
        {
            "id": "mp-23194",
            "created_at": "2022-09-04T14:39:59.931792Z",
            "structure_string": "La1 I2\n1.0\n-1.976157 1.976157 7.476211\n1.976157 -1.976157 7.476211\n1.976157 1.976157 -7.476211\nLa I\n1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.373494 0.373494 0.000000 I\n0.626506 0.626506 0.000000 I\n",
            "nsites": 3,
            "nelements": 2,
            "elements": [
                "La",
                "I"
            ],
            "chemical_system": "I-La",
            "density": 5.583949774999354,
            "density_atomic": 0.025688386290768393,
            "volume": 116.78429178239611,
            "volume_molar": 23.44304812235002,
            "formula_full": "La1 I2",
            "formula_reduced": "LaI2",
            "formula_anonymous": "AB2",
            "energy": -13.00118622,
            "energy_per_atom": -4.33372874,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -12.24318622,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0101866,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:43.406000Z",
            "spacegroup": 139
        },
        {
            "id": "mp-1104829",
            "created_at": "2022-09-04T14:40:05.098581Z",
            "structure_string": "Nb5 Sn1 Se8\n1.0\n1.729610 9.349565 0.000000\n-1.729610 9.349565 0.000000\n0.000000 2.161348 9.161780\nNb Sn Se\n5 1 8\ndirect\n0.000000 0.000000 0.000000 Nb\n0.360183 0.360183 0.998096 Nb\n0.639817 0.639817 0.001904 Nb\n0.287409 0.287409 0.369638 Nb\n0.712591 0.712591 0.630362 Nb\n0.500000 0.500000 0.500000 Sn\n0.569814 0.569814 0.800053 Se\n0.430186 0.430186 0.199947 Se\n0.083424 0.083424 0.195735 Se\n0.916576 0.916576 0.804265 Se\n0.149854 0.149854 0.492059 Se\n0.850146 0.850146 0.507941 Se\n0.240587 0.240587 0.842487 Se\n0.759413 0.759413 0.157513 Se\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Nb",
                "Sn",
                "Se"
            ],
            "chemical_system": "Nb-Se-Sn",
            "density": 6.808446210495092,
            "density_atomic": 0.04724747329924907,
            "volume": 296.312141631974,
            "volume_molar": 12.745953041462883,
            "formula_full": "Nb5 Sn1 Se8",
            "formula_reduced": "Nb5SnSe8",
            "formula_anonymous": "AB5C8",
            "energy": -96.43364943,
            "energy_per_atom": -6.888117816428571,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -92.65764943,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0934089,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:49.628000Z",
            "spacegroup": 12
        },
        {
            "id": "mp-1190557",
            "created_at": "2022-09-04T14:40:05.098776Z",
            "structure_string": "Hg8 Bi2 S4 Cl10\n1.0\n8.290289 0.000000 0.000000\n0.000000 10.690111 0.000000\n-3.556759 0.000000 8.301010\nHg Bi S Cl\n8 2 4 10\ndirect\n0.924349 0.182464 0.328852 Hg\n0.075651 0.682464 0.671148 Hg\n0.948952 0.668084 0.355429 Hg\n0.051048 0.168084 0.644571 Hg\n0.497449 0.180591 0.984772 Hg\n0.502551 0.680591 0.015228 Hg\n0.805137 0.432051 0.019853 Hg\n0.194863 0.932051 0.980147 Hg\n0.503006 0.431087 0.509849 Bi\n0.496994 0.931087 0.490151 Bi\n0.802563 0.204337 0.029056 S\n0.197437 0.704337 0.970944 S\n0.194041 0.157488 0.944499 S\n0.805959 0.657488 0.055501 S\n0.837796 0.923621 0.689949 Cl\n0.162204 0.423621 0.310051 Cl\n0.855851 0.436787 0.712832 Cl\n0.144149 0.936787 0.287168 Cl\n0.402561 0.453920 0.768957 Cl\n0.597439 0.953920 0.231043 Cl\n0.593194 0.397954 0.259978 Cl\n0.406806 0.897954 0.740022 Cl\n0.499014 0.185217 0.567851 Cl\n0.500986 0.685217 0.432149 Cl\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Hg",
                "Bi",
                "S",
                "Cl"
            ],
            "chemical_system": "Bi-Cl-Hg-S",
            "density": 5.655299646526143,
            "density_atomic": 0.032623339795262156,
            "volume": 735.669620296984,
            "volume_molar": 18.459608359517464,
            "formula_full": "Hg8 Bi2 S4 Cl10",
            "formula_reduced": "Hg4BiS2Cl5",
            "formula_anonymous": "AB2C4D5",
            "energy": -67.39412032999999,
            "energy_per_atom": -2.808088347083333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -59.242120330000006,
            "band_gap": 2.3713,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0092995,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:47.566000Z",
            "spacegroup": 4
        },
        {
            "id": "mp-1065340",
            "created_at": "2022-09-04T14:40:05.100539Z",
            "structure_string": "W4\n1.0\n2.809662 0.000000 0.000000\n0.000000 4.863870 0.000000\n0.000000 0.000000 4.923695\nW\n4\ndirect\n0.793172 0.563157 0.250000 W\n0.206828 0.063157 0.250000 W\n0.206828 0.436843 0.750000 W\n0.793172 0.936843 0.750000 W\n",
            "nsites": 4,
            "nelements": 1,
            "elements": [
                "W"
            ],
            "chemical_system": "W",
            "density": 18.14771377830403,
            "density_atomic": 0.05944739277790792,
            "volume": 67.28638234722543,
            "volume_molar": 10.130201643154267,
            "formula_full": "W4",
            "formula_reduced": "W",
            "formula_anonymous": "A",
            "energy": -49.86695147,
            "energy_per_atom": -12.4667378675,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -49.86695147,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 2.2e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:48.117000Z",
            "spacegroup": 57
        }
    ]
}