GET /third-parties/MatprojStructure/?format=api&ordering=-density_atomic&page=1759
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=-density_atomic&page=1760",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density_atomic&page=1758",
    "results": [
        {
            "id": "mp-1223873",
            "created_at": "2022-09-04T14:41:36.830686Z",
            "structure_string": "Ho1 Sc1 B2 O6\n1.0\n5.535674 -2.448742 0.000000\n5.535674 2.448742 0.000000\n4.452457 0.000000 4.100689\nHo Sc B O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.500000 0.500000 Sc\n0.754571 0.754571 0.754571 B\n0.245429 0.245429 0.245429 B\n0.045365 0.479204 0.735119 O\n0.479204 0.735119 0.045365 O\n0.735119 0.045365 0.479204 O\n0.520796 0.264881 0.954635 O\n0.264881 0.954635 0.520796 O\n0.954635 0.520796 0.264881 O\n",
            "nsites": 10,
            "nelements": 4,
            "elements": [
                "Ho",
                "Sc",
                "B",
                "O"
            ],
            "chemical_system": "B-Ho-O-Sc",
            "density": 4.891771684441527,
            "density_atomic": 0.08994968248164975,
            "volume": 111.17326625405327,
            "volume_molar": 6.695010581308669,
            "formula_full": "Ho1 Sc1 B2 O6",
            "formula_reduced": "HoSc(BO3)2",
            "formula_anonymous": "ABC2D6",
            "energy": -88.84675599000002,
            "energy_per_atom": -8.884675599000001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -84.72475599,
            "band_gap": 4.4611,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.00084,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:26.666000Z",
            "spacegroup": 148
        },
        {
            "id": "mp-755197",
            "created_at": "2022-09-04T14:43:55.848306Z",
            "structure_string": "V4 O6 F2\n1.0\n-3.013615 3.205535 3.452554\n3.013615 -3.205535 3.452554\n3.013615 3.205535 -3.452554\nV O F\n4 6 2\ndirect\n0.454500 0.704500 0.750000 V\n0.545500 0.295500 0.250000 V\n0.000000 0.000000 0.500000 V\n0.000000 0.500000 0.000000 V\n0.194861 0.444861 0.750000 O\n0.692185 0.000000 0.192185 O\n0.692185 0.500000 0.692185 O\n0.307815 0.500000 0.307815 O\n0.307815 0.000000 0.807815 O\n0.805139 0.555139 0.250000 O\n0.201476 0.951476 0.250000 F\n0.798524 0.048524 0.750000 F\n",
            "nsites": 12,
            "nelements": 3,
            "elements": [
                "V",
                "O",
                "F"
            ],
            "chemical_system": "F-O-V",
            "density": 4.204046681375384,
            "density_atomic": 0.08994820122458427,
            "volume": 133.4101164517808,
            "volume_molar": 6.695120834005131,
            "formula_full": "V4 O6 F2",
            "formula_reduced": "V2O3F",
            "formula_anonymous": "AB2C3",
            "energy": -101.88066270000002,
            "energy_per_atom": -8.490055225,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -90.0346627,
            "band_gap": 1.0315,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 5.9974681,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:20.577000Z",
            "spacegroup": 74
        },
        {
            "id": "mp-28503",
            "created_at": "2022-09-04T14:41:55.662347Z",
            "structure_string": "Al20 Si4 O38\n1.0\n2.959714 -15.145780 0.000000\n2.959714 15.145780 0.000000\n0.000000 0.000000 7.688313\nAl Si O\n20 4 38\ndirect\n0.302081 0.183451 0.993181 Al\n0.697919 0.816549 0.493181 Al\n0.816549 0.697919 0.993181 Al\n0.183451 0.302081 0.493181 Al\n0.970275 0.029725 0.838670 Al\n0.029725 0.970275 0.338670 Al\n0.475477 0.524523 0.820228 Al\n0.524523 0.475477 0.320228 Al\n0.219113 0.780887 0.824329 Al\n0.780887 0.219113 0.324329 Al\n0.144873 0.855127 0.188762 Al\n0.855127 0.144873 0.688762 Al\n0.398733 0.601267 0.162869 Al\n0.601267 0.398733 0.662869 Al\n0.898400 0.101600 0.169761 Al\n0.101600 0.898400 0.669761 Al\n0.935273 0.557406 0.508390 Al\n0.064727 0.442594 0.008390 Al\n0.442594 0.064727 0.508390 Al\n0.557406 0.935273 0.008390 Al\n0.380707 0.619293 0.784102 Si\n0.619293 0.380707 0.284102 Si\n0.242559 0.757441 0.185880 Si\n0.757441 0.242559 0.685880 Si\n0.076316 0.923684 0.471053 O\n0.923684 0.076316 0.971053 O\n0.803823 0.196177 0.552933 O\n0.196177 0.803823 0.052933 O\n0.579603 0.420397 0.438565 O\n0.420397 0.579603 0.938565 O\n0.721540 0.784609 0.709910 O\n0.278460 0.215391 0.209910 O\n0.215391 0.278460 0.709910 O\n0.784609 0.721540 0.209910 O\n0.973065 0.514256 0.703446 O\n0.026935 0.485744 0.203446 O\n0.485744 0.026935 0.703446 O\n0.514256 0.973065 0.203446 O\n0.883236 0.581456 0.306919 O\n0.116764 0.418544 0.806919 O\n0.418544 0.116764 0.306919 O\n0.581456 0.883236 0.806919 O\n0.163788 0.346665 0.280280 O\n0.836212 0.653335 0.780280 O\n0.653335 0.836212 0.280280 O\n0.346665 0.163788 0.780280 O\n0.024678 0.975322 0.919213 O\n0.975322 0.024678 0.419213 O\n0.163952 0.836048 0.638496 O\n0.836048 0.163952 0.138496 O\n0.657077 0.342923 0.595164 O\n0.342923 0.657077 0.095164 O\n0.401196 0.598804 0.590370 O\n0.598804 0.401196 0.090370 O\n0.901868 0.098132 0.565212 O\n0.098132 0.901868 0.065212 O\n0.215993 0.784007 0.381641 O\n0.784007 0.215993 0.881641 O\n0.728595 0.271405 0.446803 O\n0.271405 0.728595 0.946803 O\n0.474197 0.525803 0.426695 O\n0.525803 0.474197 0.926695 O\n",
            "nsites": 62,
            "nelements": 3,
            "elements": [
                "Al",
                "Si",
                "O"
            ],
            "chemical_system": "Al-O-Si",
            "density": 3.03528835966448,
            "density_atomic": 0.08994753109412827,
            "volume": 689.2907370088708,
            "volume_molar": 6.695170714244454,
            "formula_full": "Al20 Si4 O38",
            "formula_reduced": "Al10Si2O19",
            "formula_anonymous": "A2B10C19",
            "energy": -491.58733203,
            "energy_per_atom": -7.9288279359677425,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -465.48133203,
            "band_gap": 3.3187999999999995,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:34.947000Z",
            "spacegroup": 36
        },
        {
            "id": "mp-695545",
            "created_at": "2022-09-04T14:46:11.060461Z",
            "structure_string": "Ta1 Ti9 Al3 Zn23 O48\n1.0\n6.016884 0.000000 0.000000\n-2.998961 -5.257593 0.000000\n0.020763 0.347539 -29.521086\nTa Ti Al Zn O\n1 9 3 23 48\ndirect\n0.990188 0.498295 0.563343 Ta\n0.167570 0.833217 0.895826 Ti\n0.667084 0.833355 0.896690 Ti\n0.834938 0.166699 0.729472 Ti\n0.336160 0.168442 0.730619 Ti\n0.348459 0.668590 0.477687 Ti\n0.157378 0.833279 0.393316 Ti\n0.840202 0.163675 0.231320 Ti\n0.493189 0.503002 0.060430 Ti\n0.665775 0.333167 0.145955 Ti\n0.667382 0.835030 0.394141 Al\n0.333102 0.166512 0.229062 Al\n0.999840 0.499818 0.063337 Al\n0.002826 0.983768 0.002511 Zn\n0.675333 0.350030 0.958533 Zn\n0.167275 0.333431 0.896106 Zn\n0.323077 0.663410 0.979839 Zn\n0.342099 0.682743 0.789908 Zn\n0.832875 0.666243 0.729537 Zn\n0.998147 0.999481 0.812854 Zn\n0.659296 0.317960 0.835985 Zn\n0.024880 0.017253 0.625586 Zn\n0.496843 0.999078 0.563389 Zn\n0.655445 0.332629 0.646775 Zn\n0.494704 0.495943 0.563559 Zn\n0.323150 0.653911 0.668752 Zn\n0.673188 0.340284 0.455461 Zn\n0.161371 0.332836 0.393743 Zn\n0.332051 0.683825 0.291105 Zn\n0.988065 0.990089 0.497667 Zn\n0.837551 0.667345 0.230306 Zn\n0.002180 0.001157 0.312196 Zn\n0.665503 0.315695 0.333100 Zn\n0.003221 0.012715 0.125200 Zn\n0.496836 0.999620 0.061617 Zn\n0.330481 0.654065 0.166668 Zn\n0.025514 0.528476 0.933471 O\n0.499340 0.531028 0.935049 O\n0.346528 0.691860 0.858424 O\n0.491519 0.986815 0.932793 O\n0.695516 0.864180 0.767334 O\n0.838541 0.679817 0.859833 O\n0.988093 0.975030 0.933988 O\n0.831388 0.135461 0.858444 O\n0.166321 0.862862 0.767454 O\n0.012049 0.024878 0.692799 O\n0.158154 0.321579 0.766115 O\n0.303146 0.136295 0.858032 O\n0.370824 0.185372 0.602016 O\n0.505186 0.013991 0.693813 O\n0.654047 0.309659 0.767578 O\n0.494007 0.472481 0.692619 O\n0.850521 0.191275 0.599277 O\n0.685140 0.344862 0.522534 O\n0.849785 0.664268 0.600578 O\n0.964190 0.466698 0.690626 O\n0.039092 0.537408 0.436725 O\n0.166624 0.362756 0.517050 O\n0.314596 0.656377 0.600213 O\n0.166200 0.803513 0.519214 O\n0.503159 0.539700 0.435203 O\n0.348059 0.685920 0.359891 O\n0.490259 0.968305 0.435041 O\n0.628337 0.816459 0.519167 O\n0.683867 0.864619 0.265747 O\n0.837477 0.675546 0.359989 O\n0.981696 0.976277 0.430708 O\n0.829318 0.126094 0.357655 O\n0.170857 0.875371 0.266176 O\n0.017261 0.024770 0.192787 O\n0.161744 0.324131 0.264084 O\n0.316430 0.136252 0.359042 O\n0.369232 0.200272 0.105008 O\n0.512423 0.030923 0.187958 O\n0.501679 0.461425 0.189086 O\n0.652212 0.312887 0.264031 O\n0.831209 0.204643 0.102798 O\n0.681564 0.354041 0.027780 O\n0.964046 0.466328 0.186689 O\n0.820101 0.635607 0.103886 O\n0.170102 0.342447 0.028145 O\n0.317048 0.641639 0.099188 O\n0.161277 0.791690 0.026774 O\n0.646657 0.801122 0.025599 O\n",
            "nsites": 84,
            "nelements": 5,
            "elements": [
                "Ta",
                "Ti",
                "Al",
                "Zn",
                "O"
            ],
            "chemical_system": "Al-O-Ta-Ti-Zn",
            "density": 5.272221614578059,
            "density_atomic": 0.08994734606075207,
            "volume": 933.8796938295976,
            "volume_molar": 6.695184487080406,
            "formula_full": "Ta1 Ti9 Al3 Zn23 O48",
            "formula_reduced": "TaTi9Al3Zn23O48",
            "formula_anonymous": "AB3C9D23E48",
            "energy": -571.35407395,
            "energy_per_atom": -6.801834213690476,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -538.37807395,
            "band_gap": 1.6626000000000003,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0002469,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:21.942000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-2634",
            "created_at": "2022-09-04T14:41:14.900218Z",
            "structure_string": "Nb1 N1\n1.0\n1.488096 -2.577458 0.000000\n1.488096 2.577458 0.000000\n0.000000 0.000000 2.898656\nNb N\n1 1\ndirect\n0.333333 0.666667 0.000000 Nb\n0.000000 0.000000 0.500000 N\n",
            "nsites": 2,
            "nelements": 2,
            "elements": [
                "Nb",
                "N"
            ],
            "chemical_system": "N-Nb",
            "density": 7.9841873325546855,
            "density_atomic": 0.08994577648959197,
            "volume": 22.235618814535766,
            "volume_molar": 6.695301319341937,
            "formula_full": "Nb1 N1",
            "formula_reduced": "NbN",
            "formula_anonymous": "AB",
            "energy": -20.93419827,
            "energy_per_atom": -10.467099135,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -20.57319827,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0002504,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:21.169000Z",
            "spacegroup": 187
        },
        {
            "id": "mp-567221",
            "created_at": "2022-09-04T14:45:34.338108Z",
            "structure_string": "H20 C6 I2 N2\n1.0\n8.442870 0.000000 0.000000\n0.000000 5.619623 0.000000\n0.000000 1.767901 7.029878\nH C I N\n20 6 2 2\ndirect\n0.107390 0.693646 0.872793 H\n0.643279 0.826155 0.348009 H\n0.999929 0.531299 0.217949 H\n0.750000 0.586999 0.510646 H\n0.143279 0.173845 0.651991 H\n0.250000 0.310969 0.911021 H\n0.000071 0.468701 0.782051 H\n0.356721 0.173845 0.651991 H\n0.899189 0.282749 0.378842 H\n0.600811 0.282749 0.378842 H\n0.892610 0.306354 0.127207 H\n0.607390 0.306354 0.127207 H\n0.250000 0.413001 0.489354 H\n0.499929 0.468701 0.782051 H\n0.750000 0.689031 0.088979 H\n0.100811 0.717251 0.621158 H\n0.500071 0.531299 0.217949 H\n0.856721 0.826155 0.348009 H\n0.392610 0.693646 0.872793 H\n0.399189 0.717251 0.621158 H\n0.603627 0.409671 0.237398 C\n0.750000 0.711646 0.368336 C\n0.103627 0.590329 0.762602 C\n0.396373 0.590329 0.762602 C\n0.250000 0.288354 0.631664 C\n0.896373 0.409671 0.237398 C\n0.750000 0.035144 0.802549 I\n0.250000 0.964856 0.197451 I\n0.750000 0.562581 0.223581 N\n0.250000 0.437419 0.776419 N\n",
            "nsites": 30,
            "nelements": 4,
            "elements": [
                "H",
                "C",
                "I",
                "N"
            ],
            "chemical_system": "C-H-I-N",
            "density": 1.862208369918739,
            "density_atomic": 0.08994482539450657,
            "volume": 333.5378090781448,
            "volume_molar": 6.695372116835312,
            "formula_full": "H20 C6 I2 N2",
            "formula_reduced": "H10C3IN",
            "formula_anonymous": "ABC3D10",
            "energy": -150.9205227,
            "energy_per_atom": -5.030684089999999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -149.4405227,
            "band_gap": 4.3218,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 6.4e-06,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:08.765000Z",
            "spacegroup": 11
        },
        {
            "id": "mp-1212178",
            "created_at": "2022-09-04T14:46:32.531497Z",
            "structure_string": "In4 H36 S8 O48\n1.0\n5.647747 0.000000 0.000000\n0.000000 10.086732 0.000000\n0.000000 0.000000 18.735869\nIn H S O\n4 36 8 48\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.500000 In\n0.500000 0.500000 0.500000 In\n0.551232 0.498298 0.250000 H\n0.448768 0.501702 0.750000 H\n0.051232 0.001702 0.750000 H\n0.948768 0.998298 0.250000 H\n0.654566 0.092156 0.100000 H\n0.345434 0.907844 0.900000 H\n0.154566 0.407844 0.900000 H\n0.345434 0.907844 0.600000 H\n0.845434 0.592156 0.100000 H\n0.654566 0.092156 0.400000 H\n0.845434 0.592156 0.400000 H\n0.154566 0.407844 0.600000 H\n0.353738 0.065212 0.597312 H\n0.646262 0.934788 0.402688 H\n0.853738 0.434788 0.402688 H\n0.646262 0.934788 0.097312 H\n0.146262 0.565212 0.597312 H\n0.353738 0.065212 0.902688 H\n0.146262 0.565212 0.902688 H\n0.853738 0.434788 0.097312 H\n0.525901 0.659930 0.205543 H\n0.474099 0.340070 0.794457 H\n0.025901 0.840070 0.794457 H\n0.474099 0.340070 0.705543 H\n0.974099 0.159930 0.205543 H\n0.525901 0.659930 0.294457 H\n0.974099 0.159930 0.294457 H\n0.025901 0.840070 0.705543 H\n0.504403 0.319242 0.206749 H\n0.495597 0.680758 0.793251 H\n0.004403 0.180758 0.793251 H\n0.495597 0.680758 0.706749 H\n0.995597 0.819242 0.206749 H\n0.504403 0.319242 0.293251 H\n0.995597 0.819242 0.293251 H\n0.004403 0.180758 0.706749 H\n0.222222 0.259666 0.091521 S\n0.777778 0.740334 0.908479 S\n0.722222 0.240334 0.908479 S\n0.777778 0.740334 0.591521 S\n0.277778 0.759666 0.091521 S\n0.222222 0.259666 0.408479 S\n0.277778 0.759666 0.408479 S\n0.722222 0.240334 0.591521 S\n0.247609 0.401455 0.066816 O\n0.752391 0.598545 0.933184 O\n0.747609 0.098545 0.933184 O\n0.752391 0.598545 0.566816 O\n0.252391 0.901455 0.066816 O\n0.247609 0.401455 0.433184 O\n0.252391 0.901455 0.433184 O\n0.747609 0.098545 0.566816 O\n0.194037 0.176874 0.025271 O\n0.805963 0.823126 0.974729 O\n0.694037 0.323126 0.974729 O\n0.805963 0.823126 0.525271 O\n0.305963 0.676874 0.025271 O\n0.194037 0.176874 0.474729 O\n0.305963 0.676874 0.474729 O\n0.694037 0.323126 0.525271 O\n0.435461 0.216846 0.131212 O\n0.564539 0.783154 0.868788 O\n0.935461 0.283154 0.868788 O\n0.564539 0.783154 0.631212 O\n0.064539 0.716846 0.131212 O\n0.435461 0.216846 0.368788 O\n0.064539 0.716846 0.368788 O\n0.935461 0.283154 0.631212 O\n0.753130 0.011608 0.092716 O\n0.246870 0.988392 0.907284 O\n0.253130 0.488392 0.907284 O\n0.246870 0.988392 0.592716 O\n0.746870 0.511608 0.092716 O\n0.753130 0.011608 0.407284 O\n0.746870 0.511608 0.407284 O\n0.253130 0.488392 0.592716 O\n0.552846 0.369450 0.250000 O\n0.447154 0.630550 0.750000 O\n0.052846 0.130550 0.750000 O\n0.947154 0.869450 0.250000 O\n0.567576 0.609144 0.250000 O\n0.432424 0.390856 0.750000 O\n0.067576 0.890856 0.750000 O\n0.932424 0.109144 0.250000 O\n0.005626 0.257068 0.135746 O\n0.994374 0.742932 0.864254 O\n0.505626 0.242932 0.864254 O\n0.994374 0.742932 0.635746 O\n0.494374 0.757068 0.135746 O\n0.005626 0.257068 0.364254 O\n0.494374 0.757068 0.364254 O\n0.505626 0.242932 0.635746 O\n",
            "nsites": 96,
            "nelements": 4,
            "elements": [
                "In",
                "H",
                "S",
                "O"
            ],
            "chemical_system": "H-In-O-S",
            "density": 2.364869282303697,
            "density_atomic": 0.08994389203309151,
            "volume": 1067.3320648019142,
            "volume_molar": 6.695441595727676,
            "formula_full": "In4 H36 S8 O48",
            "formula_reduced": "InH9(SO6)2",
            "formula_anonymous": "AB2C9D12",
            "energy": -553.14251905,
            "energy_per_atom": -5.761901240104167,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -520.16651905,
            "band_gap": 4.1792,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0066381,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:28.495000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-778990",
            "created_at": "2022-09-04T14:43:44.887524Z",
            "structure_string": "Fe10 O14 F6\n1.0\n15.209294 0.000000 0.000000\n0.000000 4.681239 0.000000\n0.000000 0.136190 4.684692\nFe O F\n10 14 6\ndirect\n0.206869 0.019505 0.037828 Fe\n0.400925 0.973876 0.978665 Fe\n0.599075 0.973876 0.978665 Fe\n0.793131 0.019505 0.037828 Fe\n0.000000 0.978694 0.010306 Fe\n0.299471 0.495101 0.505717 Fe\n0.700529 0.495101 0.505717 Fe\n0.500000 0.510117 0.514882 Fe\n0.905191 0.513162 0.472681 Fe\n0.094809 0.513162 0.472681 Fe\n0.304043 0.799275 0.198272 O\n0.500000 0.794256 0.184496 O\n0.695957 0.799275 0.198272 O\n0.895887 0.820638 0.188436 O\n0.104113 0.820638 0.188436 O\n0.202163 0.321262 0.321754 O\n0.797837 0.321262 0.321754 O\n0.000000 0.306875 0.290130 O\n0.397717 0.676113 0.683747 O\n0.602283 0.676113 0.683747 O\n0.000000 0.700741 0.690463 O\n0.302240 0.191182 0.810932 O\n0.697760 0.191182 0.810932 O\n0.500000 0.180026 0.799972 O\n0.401635 0.292117 0.301983 F\n0.598365 0.292117 0.301983 F\n0.199156 0.706025 0.703366 F\n0.800844 0.706025 0.703366 F\n0.103168 0.206390 0.801496 F\n0.896832 0.206390 0.801496 F\n",
            "nsites": 30,
            "nelements": 3,
            "elements": [
                "Fe",
                "O",
                "F"
            ],
            "chemical_system": "F-Fe-O",
            "density": 4.4628834517645775,
            "density_atomic": 0.0899436157198191,
            "volume": 333.5422949134287,
            "volume_molar": 6.695462164606999,
            "formula_full": "Fe10 O14 F6",
            "formula_reduced": "Fe5O7F3",
            "formula_anonymous": "A3B5C7",
            "energy": -217.27055344,
            "energy_per_atom": -7.2423517813333325,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -182.32055344,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 46.0010317,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:19.170000Z",
            "spacegroup": 6
        },
        {
            "id": "mp-1233399",
            "created_at": "2022-09-04T14:45:33.191550Z",
            "structure_string": "Mg1 Fe10 O16 F4\n1.0\n-4.828854 -0.089715 0.050495\n0.301412 9.036289 -9.191730\n-0.061462 -4.638968 -3.184082\nMg Fe O F\n1 10 16 4\ndirect\n0.652699 0.144433 0.035728 Mg\n0.540183 0.989575 0.456579 Fe\n0.461465 0.413092 0.344082 Fe\n0.341482 0.248322 0.789701 Fe\n0.506196 0.605234 0.713917 Fe\n0.551209 0.797710 0.080042 Fe\n0.913049 0.400171 0.843707 Fe\n0.017325 0.801685 0.592520 Fe\n0.077976 0.190641 0.345855 Fe\n0.975759 0.596460 0.237067 Fe\n0.080783 0.984761 0.974932 Fe\n0.725299 0.259382 0.827276 O\n0.855854 0.853145 0.893311 O\n0.820590 0.669315 0.535403 O\n0.839696 0.062930 0.252727 O\n0.772369 0.464134 0.160008 O\n0.660585 0.467836 0.655335 O\n0.683779 0.658154 0.028954 O\n0.733449 0.855031 0.379918 O\n0.239323 0.350118 0.048607 O\n0.337259 0.737142 0.792488 O\n0.335855 0.129592 0.533418 O\n0.369263 0.930990 0.144563 O\n0.285597 0.546938 0.427196 O\n0.241345 0.141673 0.019501 O\n0.234166 0.929396 0.646020 O\n0.183365 0.326442 0.562440 O\n0.758153 0.041008 0.760150 F\n0.709152 0.266038 0.306427 F\n0.165082 0.541614 0.914543 F\n0.209475 0.737668 0.280918 F\n",
            "nsites": 31,
            "nelements": 4,
            "elements": [
                "Mg",
                "Fe",
                "O",
                "F"
            ],
            "chemical_system": "F-Fe-Mg-O",
            "density": 4.407114781456517,
            "density_atomic": 0.0899434943861799,
            "volume": 344.66083635686766,
            "volume_molar": 6.695471196775428,
            "formula_full": "Mg1 Fe10 O16 F4",
            "formula_reduced": "MgFe10(O4F)4",
            "formula_anonymous": "AB4C10D16",
            "energy": -225.25872424,
            "energy_per_atom": -7.266410459354838,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -189.85872424,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 46.0000002,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:05.990000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1094044",
            "created_at": "2022-09-04T14:47:28.904165Z",
            "structure_string": "Sr1 Ca3 Mn4 O12\n1.0\n7.621994 0.000000 0.000000\n0.000000 5.388073 0.000000\n0.000000 0.015960 5.414568\nSr Ca Mn O\n1 3 4 12\ndirect\n0.000000 0.506051 0.472000 Sr\n0.500000 0.006706 0.036652 Ca\n0.500000 0.492425 0.539364 Ca\n0.000000 0.991986 0.961594 Ca\n0.252137 0.500652 0.001396 Mn\n0.252389 0.999315 0.500355 Mn\n0.747611 0.999315 0.500355 Mn\n0.747863 0.500652 0.001396 Mn\n0.290566 0.289707 0.287772 O\n0.215939 0.793262 0.208279 O\n0.711421 0.212168 0.786996 O\n0.778415 0.716824 0.718015 O\n0.221585 0.716824 0.718015 O\n0.288579 0.212168 0.786996 O\n0.784061 0.793262 0.208279 O\n0.709434 0.289707 0.287772 O\n0.500000 0.924463 0.476436 O\n0.000000 0.426296 0.006818 O\n0.500000 0.574168 0.979117 O\n0.000000 0.054047 0.522392 O\n",
            "nsites": 20,
            "nelements": 4,
            "elements": [
                "Sr",
                "Ca",
                "Mn",
                "O"
            ],
            "chemical_system": "Ca-Mn-O-Sr",
            "density": 4.626940403441725,
            "density_atomic": 0.08994232497699232,
            "volume": 222.36472100444473,
            "volume_molar": 6.695558249734473,
            "formula_full": "Sr1 Ca3 Mn4 O12",
            "formula_reduced": "SrCa3Mn4O12",
            "formula_anonymous": "AB3C4D12",
            "energy": -153.31562539,
            "energy_per_atom": -7.6657812695,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -138.39962539,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0016088,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:10.465000Z",
            "spacegroup": 6
        },
        {
            "id": "mp-1042170",
            "created_at": "2022-09-04T14:44:27.015025Z",
            "structure_string": "Ca2 Fe4 O8\n1.0\n1.532679 -5.009366 0.000000\n1.532679 5.009366 0.000000\n0.000000 0.000000 10.136888\nCa Fe O\n2 4 8\ndirect\n0.609775 0.390225 0.750000 Ca\n0.390225 0.609775 0.250000 Ca\n0.135405 0.864595 0.070735 Fe\n0.864595 0.135405 0.929265 Fe\n0.135405 0.864595 0.429265 Fe\n0.864595 0.135405 0.570735 Fe\n0.768659 0.231341 0.392169 O\n0.231341 0.768659 0.607831 O\n0.231341 0.768659 0.892169 O\n0.768659 0.231341 0.107831 O\n0.060232 0.939768 0.250000 O\n0.939768 0.060232 0.750000 O\n0.500000 0.500000 0.000000 O\n0.500000 0.500000 0.500000 O\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Ca",
                "Fe",
                "O"
            ],
            "chemical_system": "Ca-Fe-O",
            "density": 4.603548086457876,
            "density_atomic": 0.08994135398395746,
            "volume": 155.65698513385883,
            "volume_molar": 6.695630533952324,
            "formula_full": "Ca2 Fe4 O8",
            "formula_reduced": "Ca(FeO2)2",
            "formula_anonymous": "AB2C4",
            "energy": -107.53267351,
            "energy_per_atom": -7.680905250714285,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -93.01267351,
            "band_gap": 1.0006000000000004,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 19.9997801,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:36.923000Z",
            "spacegroup": 63
        },
        {
            "id": "mp-756653",
            "created_at": "2022-09-04T14:44:42.724672Z",
            "structure_string": "Li4 V4 Si4 O16\n1.0\n9.334967 0.013508 0.183318\n0.946411 5.547462 -0.164538\n-1.685987 -1.327854 6.023786\nLi V Si O\n4 4 4 16\ndirect\n0.137841 0.196385 0.383372 Li\n0.220602 0.698239 0.431761 Li\n0.779423 0.301890 0.568103 Li\n0.862071 0.803850 0.616667 Li\n0.206157 0.707450 0.928888 V\n0.425525 0.215161 0.165243 V\n0.574450 0.784829 0.834657 V\n0.793706 0.292550 0.071291 V\n0.095433 0.164683 0.827840 Si\n0.462418 0.322281 0.709480 Si\n0.537618 0.677701 0.290451 Si\n0.904604 0.835250 0.172085 Si\n0.146860 0.364342 0.726505 O\n0.100706 0.868673 0.676107 O\n0.075957 0.753569 0.142395 O\n0.212641 0.115766 0.059691 O\n0.446536 0.126038 0.846500 O\n0.385651 0.617140 0.777624 O\n0.387758 0.221060 0.451408 O\n0.360936 0.613405 0.217516 O\n0.639083 0.386605 0.782491 O\n0.612302 0.778917 0.548703 O\n0.614363 0.382798 0.222429 O\n0.553490 0.873950 0.153600 O\n0.787348 0.884216 0.940298 O\n0.924029 0.246355 0.857562 O\n0.899343 0.131309 0.323867 O\n0.853149 0.635588 0.273467 O\n",
            "nsites": 28,
            "nelements": 4,
            "elements": [
                "Li",
                "V",
                "Si",
                "O"
            ],
            "chemical_system": "Li-O-Si-V",
            "density": 3.1996325852563214,
            "density_atomic": 0.08994093625970602,
            "volume": 311.3154161432066,
            "volume_molar": 6.69566163132988,
            "formula_full": "Li4 V4 Si4 O16",
            "formula_reduced": "LiVSiO4",
            "formula_anonymous": "ABCD4",
            "energy": -222.16617704,
            "energy_per_atom": -7.9345063228571435,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -204.37417704,
            "band_gap": 1.9342,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 7.9986048,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:42.962000Z",
            "spacegroup": 2
        }
    ]
}