GET /third-parties/MatprojStructure/?format=api&ordering=volume&page=11458
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=volume&page=11459",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=volume&page=11457",
    "results": [
        {
            "id": "mp-1202272",
            "created_at": "2022-09-04T14:43:53.425806Z",
            "structure_string": "K8 I16 O48\n1.0\n7.484714 0.000000 0.000000\n0.000000 8.573994 0.000000\n0.000000 0.000000 20.001885\nK I O\n8 16 48\ndirect\n0.521234 0.514877 0.853372 K\n0.478766 0.485123 0.353372 K\n0.521234 0.985123 0.353372 K\n0.478766 0.014877 0.853372 K\n0.990451 0.536722 0.657307 K\n0.009549 0.463278 0.157307 K\n0.990451 0.963278 0.157307 K\n0.009549 0.036722 0.657307 K\n0.814676 0.823210 0.503815 I\n0.185324 0.176790 0.003815 I\n0.814676 0.676790 0.003815 I\n0.185324 0.323210 0.503815 I\n0.313476 0.735513 0.504614 I\n0.686524 0.264487 0.004614 I\n0.313476 0.764487 0.004614 I\n0.686524 0.235513 0.504614 I\n0.960283 0.815908 0.832756 I\n0.039717 0.184092 0.332756 I\n0.960283 0.684092 0.332756 I\n0.039717 0.315908 0.832756 I\n0.525641 0.756810 0.690584 I\n0.474359 0.243190 0.190584 I\n0.525641 0.743190 0.190584 I\n0.474359 0.256810 0.690584 I\n0.728609 0.640506 0.463147 O\n0.271391 0.359494 0.963147 O\n0.728609 0.859494 0.963147 O\n0.271391 0.140506 0.463147 O\n0.604472 0.931766 0.486940 O\n0.395528 0.068234 0.986940 O\n0.604472 0.568234 0.986940 O\n0.395528 0.431766 0.486940 O\n0.783588 0.786621 0.593121 O\n0.216412 0.213379 0.093121 O\n0.783588 0.713379 0.093121 O\n0.216412 0.286621 0.593121 O\n0.105066 0.627884 0.526146 O\n0.894934 0.372116 0.026146 O\n0.105066 0.872116 0.026146 O\n0.894934 0.127884 0.526146 O\n0.200823 0.921399 0.532631 O\n0.799177 0.078601 0.032631 O\n0.200823 0.578601 0.032631 O\n0.799177 0.421399 0.532631 O\n0.281394 0.750235 0.414372 O\n0.718606 0.249765 0.914372 O\n0.281394 0.749765 0.914372 O\n0.718606 0.250235 0.414372 O\n0.086035 0.774397 0.754109 O\n0.913965 0.225603 0.254109 O\n0.086035 0.725603 0.254109 O\n0.913965 0.274397 0.754109 O\n0.884398 0.621429 0.858082 O\n0.115602 0.378571 0.358082 O\n0.884398 0.878571 0.358082 O\n0.115602 0.121429 0.858082 O\n0.764087 0.886354 0.787082 O\n0.235913 0.113646 0.287082 O\n0.764087 0.613646 0.287082 O\n0.235913 0.386354 0.787082 O\n0.348301 0.693567 0.634050 O\n0.651699 0.306433 0.134050 O\n0.348301 0.806433 0.134050 O\n0.651699 0.193567 0.634050 O\n0.396315 0.754533 0.771296 O\n0.603685 0.245467 0.271296 O\n0.396315 0.745467 0.271296 O\n0.603685 0.254533 0.771296 O\n0.641310 0.572495 0.704976 O\n0.358690 0.427505 0.204976 O\n0.641310 0.927505 0.204976 O\n0.358690 0.072495 0.704976 O\n",
            "nsites": 72,
            "nelements": 3,
            "elements": [
                "K",
                "I",
                "O"
            ],
            "chemical_system": "I-K-O",
            "density": 4.024869291618583,
            "density_atomic": 0.0560922918612805,
            "volume": 1283.598826342489,
            "volume_molar": 10.736128905007313,
            "formula_full": "K8 I16 O48",
            "formula_reduced": "K(IO3)2",
            "formula_anonymous": "AB2C6",
            "energy": -340.79233946,
            "energy_per_atom": -4.733226936944444,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -307.81633946,
            "band_gap": 0.2617,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 8.0043434,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:24.734000Z",
            "spacegroup": 29
        },
        {
            "id": "mp-1211929",
            "created_at": "2022-09-04T14:44:22.135817Z",
            "structure_string": "K8 Te4 Mo8 P8 O56\n1.0\n8.866172 0.000000 0.000000\n0.000000 11.379623 0.000000\n0.000000 0.000000 12.723335\nK Te Mo P O\n8 4 8 8 56\ndirect\n0.028742 0.217401 0.303665 K\n0.971258 0.782599 0.696335 K\n0.471258 0.717401 0.196335 K\n0.028742 0.282599 0.696335 K\n0.528742 0.282599 0.803665 K\n0.971258 0.717401 0.303665 K\n0.471258 0.782599 0.803665 K\n0.528742 0.217401 0.196335 K\n0.139852 0.250000 0.000000 Te\n0.860148 0.750000 0.000000 Te\n0.360148 0.750000 0.500000 Te\n0.639852 0.250000 0.500000 Te\n0.237819 0.478983 0.379911 Mo\n0.762181 0.521017 0.620089 Mo\n0.262181 0.978983 0.120089 Mo\n0.237819 0.021017 0.620089 Mo\n0.737819 0.021017 0.879911 Mo\n0.762181 0.978983 0.379911 Mo\n0.262181 0.521017 0.879911 Mo\n0.737819 0.478983 0.120089 Mo\n0.356887 0.005914 0.369759 P\n0.643113 0.994086 0.630241 P\n0.143113 0.505914 0.130241 P\n0.356887 0.494086 0.630241 P\n0.856887 0.494086 0.869759 P\n0.643113 0.505914 0.369759 P\n0.143113 0.994086 0.869759 P\n0.856887 0.005914 0.130241 P\n0.272509 0.058460 0.466126 O\n0.727491 0.941540 0.533874 O\n0.227491 0.558460 0.033874 O\n0.272509 0.441540 0.533874 O\n0.772509 0.441540 0.966126 O\n0.727491 0.558460 0.466126 O\n0.227491 0.941540 0.966126 O\n0.772509 0.058460 0.033874 O\n0.310417 0.344005 0.338330 O\n0.689583 0.655995 0.661670 O\n0.189583 0.844005 0.161670 O\n0.310417 0.155995 0.661670 O\n0.810417 0.155995 0.838330 O\n0.689583 0.844005 0.338330 O\n0.189583 0.655995 0.838330 O\n0.810417 0.344005 0.161670 O\n0.020964 0.050111 0.128569 O\n0.979036 0.949889 0.871430 O\n0.479036 0.550111 0.371431 O\n0.020964 0.449889 0.871430 O\n0.520964 0.449889 0.628570 O\n0.979036 0.550111 0.128569 O\n0.479036 0.949889 0.628570 O\n0.520964 0.050111 0.371431 O\n0.282059 0.155335 0.071522 O\n0.717941 0.844665 0.928478 O\n0.217941 0.655335 0.428478 O\n0.282059 0.344665 0.928478 O\n0.782059 0.344665 0.571522 O\n0.717941 0.655335 0.071522 O\n0.217941 0.844665 0.571522 O\n0.782059 0.155335 0.428478 O\n0.045807 0.451778 0.379621 O\n0.954193 0.548222 0.620379 O\n0.454193 0.951778 0.120379 O\n0.045807 0.048222 0.620379 O\n0.545807 0.048222 0.879621 O\n0.954193 0.951778 0.379621 O\n0.454193 0.548222 0.879621 O\n0.545807 0.451778 0.120379 O\n0.274722 0.053039 0.269499 O\n0.725278 0.946961 0.730501 O\n0.225278 0.553039 0.230501 O\n0.274722 0.446961 0.730501 O\n0.774722 0.446961 0.769499 O\n0.725278 0.553039 0.269499 O\n0.225278 0.946961 0.769499 O\n0.774722 0.053039 0.230501 O\n0.154870 0.369635 0.130235 O\n0.845130 0.630365 0.869765 O\n0.345130 0.869635 0.369765 O\n0.154870 0.130365 0.869765 O\n0.654870 0.130365 0.630235 O\n0.845130 0.869635 0.130235 O\n0.345130 0.630365 0.630235 O\n0.654870 0.369635 0.369765 O\n",
            "nsites": 84,
            "nelements": 5,
            "elements": [
                "K",
                "Te",
                "Mo",
                "P",
                "O"
            ],
            "chemical_system": "K-Mo-O-P-Te",
            "density": 3.537171715511989,
            "density_atomic": 0.06543563140448894,
            "volume": 1283.7042784955465,
            "volume_molar": 9.20315221346955,
            "formula_full": "K8 Te4 Mo8 P8 O56",
            "formula_reduced": "K2TeMo2(PO7)2",
            "formula_anonymous": "AB2C2D2E14",
            "energy": -618.77915016,
            "energy_per_atom": -7.366418454285714,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -554.69115016,
            "band_gap": 2.9747,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0030589,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:24.741000Z",
            "spacegroup": 60
        },
        {
            "id": "mp-1201393",
            "created_at": "2022-09-04T14:43:01.634377Z",
            "structure_string": "Na12 U2 H48 C10 O54\n1.0\n9.664603 0.000000 0.000000\n-0.569871 9.847496 0.000000\n-3.436156 -0.499917 13.488446\nNa U H C O\n12 2 48 10 54\ndirect\n0.804927 0.754451 0.195534 Na\n0.195073 0.245549 0.804466 Na\n0.854431 0.410166 0.910270 Na\n0.145569 0.589834 0.089730 Na\n0.872652 0.095441 0.845192 Na\n0.127348 0.904559 0.154808 Na\n0.404442 0.858937 0.041705 Na\n0.595558 0.141063 0.958295 Na\n0.813877 0.436792 0.440077 Na\n0.186123 0.563208 0.559923 Na\n0.610043 0.152922 0.492384 Na\n0.389957 0.847078 0.507616 Na\n0.762429 0.712894 0.768570 U\n0.237571 0.287106 0.231430 U\n0.614222 0.179868 0.748304 H\n0.385778 0.820132 0.251696 H\n0.626401 0.326334 0.802928 H\n0.373599 0.673666 0.197072 H\n0.804707 0.944521 0.987781 H\n0.195293 0.055479 0.012219 H\n0.887669 0.065729 0.062373 H\n0.112331 0.934271 0.937627 H\n0.917639 0.618732 0.356674 H\n0.082361 0.381268 0.643326 H\n0.961326 0.530783 0.277581 H\n0.038674 0.469217 0.722419 H\n0.609048 0.575158 0.480075 H\n0.390952 0.424842 0.519925 H\n0.498885 0.522341 0.382919 H\n0.501115 0.477659 0.617081 H\n0.661049 0.713620 0.355296 H\n0.338951 0.286380 0.644704 H\n0.652179 0.870262 0.342562 H\n0.347821 0.129738 0.657438 H\n0.764908 0.178631 0.332774 H\n0.235092 0.821369 0.667226 H\n0.628022 0.264212 0.303521 H\n0.371978 0.735788 0.696479 H\n0.842419 0.335672 0.087517 H\n0.157581 0.664328 0.912483 H\n0.687826 0.387790 0.080901 H\n0.312174 0.612210 0.919099 H\n0.575997 0.626395 0.080413 H\n0.424003 0.373605 0.919587 H\n0.644806 0.728835 0.013283 H\n0.355194 0.271165 0.986717 H\n0.334344 0.939827 0.838481 H\n0.665656 0.060173 0.161519 H\n0.481465 0.878336 0.848077 H\n0.518535 0.121664 0.151923 H\n0.747073 0.913750 0.535476 H\n0.252927 0.086250 0.464524 H\n0.847451 0.035608 0.584168 H\n0.152549 0.964392 0.415832 H\n0.101506 0.764519 0.342570 H\n0.898494 0.235481 0.657430 H\n0.977825 0.871275 0.340323 H\n0.022175 0.128725 0.659677 H\n0.039564 0.293734 0.416640 H\n0.960436 0.706266 0.583360 H\n0.068508 0.247033 0.523333 H\n0.931492 0.752967 0.476667 H\n0.780065 0.461523 0.653963 C\n0.219935 0.538477 0.346037 C\n0.525700 0.575225 0.830891 C\n0.474300 0.424775 0.169109 C\n0.617025 0.943937 0.675527 C\n0.382975 0.056063 0.324473 C\n0.890509 0.716231 0.984262 C\n0.109491 0.283769 0.015738 C\n0.031072 0.860014 0.751293 C\n0.968928 0.139986 0.248707 C\n0.870727 0.494396 0.738715 O\n0.129273 0.505604 0.261285 O\n0.680780 0.548584 0.624100 O\n0.319220 0.451416 0.375900 O\n0.788073 0.354921 0.602183 O\n0.211927 0.645079 0.397817 O\n0.640886 0.511912 0.828501 O\n0.359114 0.488088 0.171499 O\n0.520102 0.693943 0.787719 O\n0.479898 0.306057 0.212281 O\n0.430823 0.529095 0.871310 O\n0.569177 0.470905 0.128690 O\n0.775101 0.779035 0.942959 O\n0.224899 0.220965 0.057041 O\n0.936572 0.637385 0.924070 O\n0.063428 0.362615 0.075930 O\n0.951335 0.732441 0.076452 O\n0.048665 0.267559 0.923548 O\n0.682944 0.939487 0.769627 O\n0.317056 0.060513 0.230373 O\n0.622378 0.832961 0.622469 O\n0.377622 0.167039 0.377531 O\n0.554305 0.048051 0.638594 O\n0.445695 0.951949 0.361406 O\n0.980306 0.886331 0.828259 O\n0.019694 0.113669 0.171741 O\n0.948261 0.769435 0.686995 O\n0.051739 0.230565 0.313005 O\n0.146260 0.914727 0.738742 O\n0.853740 0.085273 0.261258 O\n0.662407 0.234372 0.809218 O\n0.337593 0.765628 0.190782 O\n0.818637 0.044903 0.997407 O\n0.181363 0.955097 0.002593 O\n0.875526 0.558140 0.299309 O\n0.124474 0.441860 0.700691 O\n0.597675 0.563545 0.407949 O\n0.402325 0.436455 0.592051 O\n0.709875 0.794752 0.334158 O\n0.290125 0.205248 0.665842 O\n0.702772 0.236971 0.361129 O\n0.297228 0.763029 0.638871 O\n0.748843 0.344122 0.042294 O\n0.251157 0.655878 0.957706 O\n0.599765 0.724023 0.069508 O\n0.400235 0.275977 0.930492 O\n0.432789 0.943249 0.880567 O\n0.567211 0.056751 0.119433 O\n0.796499 0.996095 0.518695 O\n0.203501 0.003905 0.481305 O\n0.051930 0.844248 0.308387 O\n0.948070 0.155752 0.691613 O\n0.042312 0.328466 0.486280 O\n0.957688 0.671534 0.513720 O\n",
            "nsites": 126,
            "nelements": 5,
            "elements": [
                "Na",
                "U",
                "H",
                "C",
                "O"
            ],
            "chemical_system": "C-H-Na-O-U",
            "density": 2.3081674716434164,
            "density_atomic": 0.09815191910954126,
            "volume": 1283.7242627867442,
            "volume_molar": 6.1355303234357175,
            "formula_full": "Na12 U2 H48 C10 O54",
            "formula_reduced": "Na6UH24C5O27",
            "formula_anonymous": "AB5C6D24E27",
            "energy": -768.7767966499999,
            "energy_per_atom": -6.101403148015873,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -731.67879665,
            "band_gap": 0.3919000000000001,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0005761,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:03.439000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1202363",
            "created_at": "2022-09-04T14:40:26.028174Z",
            "structure_string": "V12 S8 N4 O48\n1.0\n7.939962 0.000000 0.000000\n0.000000 20.390708 0.000000\n-0.493867 0.000000 7.929460\nV S N O\n12 8 4 48\ndirect\n0.341585 0.323353 0.615436 V\n0.658415 0.823353 0.384564 V\n0.282494 0.484931 0.400234 V\n0.717506 0.984931 0.599766 V\n0.967484 0.392866 0.728855 V\n0.032516 0.892866 0.271145 V\n0.067672 0.323089 0.352135 V\n0.932328 0.823089 0.647865 V\n0.281115 0.160558 0.401063 V\n0.718885 0.660558 0.598937 V\n0.966482 0.256191 0.732905 V\n0.033518 0.756191 0.267095 V\n0.339283 0.461027 0.802111 S\n0.660717 0.961027 0.197889 S\n0.880064 0.460322 0.358620 S\n0.119936 0.960322 0.641380 S\n0.336081 0.185224 0.803221 S\n0.663919 0.685224 0.196779 S\n0.878437 0.185984 0.365686 S\n0.121563 0.685984 0.634314 S\n0.582303 0.320830 0.105673 N\n0.417697 0.820830 0.894327 N\n0.942458 0.566058 0.993272 N\n0.057542 0.066058 0.006728 N\n0.501994 0.324544 0.502881 O\n0.498006 0.824544 0.497119 O\n0.411245 0.447115 0.271682 O\n0.588755 0.947115 0.728318 O\n0.341703 0.559207 0.332555 O\n0.658297 0.059207 0.667445 O\n0.833669 0.406752 0.867981 O\n0.166331 0.906752 0.132019 O\n0.172904 0.323024 0.186612 O\n0.827096 0.823024 0.813388 O\n0.408391 0.202889 0.277742 O\n0.591609 0.702889 0.722258 O\n0.347441 0.089395 0.323160 O\n0.652559 0.589395 0.676840 O\n0.833108 0.243952 0.873366 O\n0.166892 0.743952 0.126634 O\n0.405262 0.390605 0.781468 O\n0.594738 0.890605 0.218532 O\n0.368417 0.493967 0.625331 O\n0.631583 0.993967 0.374669 O\n0.147115 0.457435 0.806909 O\n0.852885 0.957435 0.193091 O\n0.884184 0.457548 0.551609 O\n0.115816 0.957548 0.448391 O\n0.054507 0.493210 0.319677 O\n0.945493 0.993210 0.680323 O\n0.897763 0.389830 0.293567 O\n0.102237 0.889830 0.706433 O\n0.407780 0.254419 0.775764 O\n0.592220 0.754419 0.224236 O\n0.357589 0.149624 0.627825 O\n0.642411 0.649624 0.372175 O\n0.145149 0.191616 0.812694 O\n0.854851 0.691616 0.187306 O\n0.051312 0.151429 0.328353 O\n0.948688 0.651429 0.671647 O\n0.882915 0.190490 0.558259 O\n0.117085 0.690490 0.441741 O\n0.899103 0.255715 0.296041 O\n0.100897 0.755715 0.703959 O\n0.191151 0.385319 0.496274 O\n0.808849 0.885319 0.503726 O\n0.191346 0.261787 0.496934 O\n0.808654 0.761787 0.503066 O\n0.878565 0.324075 0.596508 O\n0.121435 0.824075 0.403492 O\n0.105715 0.324520 0.812703 O\n0.894285 0.824520 0.187297 O\n",
            "nsites": 72,
            "nelements": 4,
            "elements": [
                "V",
                "S",
                "N",
                "O"
            ],
            "chemical_system": "N-O-S-V",
            "density": 2.1883051542571668,
            "density_atomic": 0.056083893295213544,
            "volume": 1283.791045336448,
            "volume_molar": 10.737736640893935,
            "formula_full": "V12 S8 N4 O48",
            "formula_reduced": "V3S2NO12",
            "formula_anonymous": "AB2C3D12",
            "energy": -518.13498126,
            "energy_per_atom": -7.196319184166667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -464.75898126,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 15.8684197,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:54.940000Z",
            "spacegroup": 4
        },
        {
            "id": "mp-772287",
            "created_at": "2022-09-04T14:41:34.943438Z",
            "structure_string": "Li4 Si24 Ni10 O60\n1.0\n5.075217 -8.790533 0.000000\n5.075217 8.790533 0.000000\n0.000000 0.000000 14.388042\nLi Si Ni O\n4 24 10 60\ndirect\n0.333333 0.666667 0.750000 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.666667 0.333333 0.250000 Li\n0.114693 0.759623 0.360816 Si\n0.114693 0.759623 0.139184 Si\n0.237508 0.882978 0.860583 Si\n0.237508 0.882978 0.639417 Si\n0.117022 0.354530 0.860583 Si\n0.117022 0.354530 0.639417 Si\n0.240377 0.355070 0.139184 Si\n0.240377 0.355070 0.360816 Si\n0.644930 0.885307 0.139184 Si\n0.644930 0.885307 0.360816 Si\n0.355070 0.240377 0.860816 Si\n0.355070 0.240377 0.639184 Si\n0.645470 0.762492 0.639417 Si\n0.645470 0.762492 0.860583 Si\n0.354530 0.117022 0.360583 Si\n0.354530 0.117022 0.139417 Si\n0.762492 0.645470 0.139417 Si\n0.762492 0.645470 0.360583 Si\n0.885307 0.644930 0.860816 Si\n0.885307 0.644930 0.639184 Si\n0.759623 0.114693 0.860816 Si\n0.759623 0.114693 0.639184 Si\n0.882978 0.237508 0.139417 Si\n0.882978 0.237508 0.360583 Si\n0.000000 0.488231 0.500000 Ni\n0.000000 0.488231 0.000000 Ni\n0.333333 0.666667 0.001318 Ni\n0.333333 0.666667 0.498682 Ni\n0.511769 0.511769 0.000000 Ni\n0.511769 0.511769 0.500000 Ni\n0.666667 0.333333 0.998682 Ni\n0.666667 0.333333 0.501318 Ni\n0.488231 0.000000 0.000000 Ni\n0.488231 0.000000 0.500000 Ni\n0.056759 0.785818 0.612712 O\n0.056759 0.785818 0.887288 O\n0.225172 0.941251 0.385135 O\n0.225172 0.941251 0.114865 O\n0.125018 0.734026 0.250000 O\n0.153219 0.652777 0.076714 O\n0.153219 0.652777 0.423286 O\n0.259409 0.855996 0.750000 O\n0.162241 0.508712 0.915779 O\n0.162241 0.508712 0.584221 O\n0.058749 0.283921 0.114865 O\n0.058749 0.283921 0.385135 O\n0.346471 0.837759 0.915779 O\n0.346471 0.837759 0.584221 O\n0.144004 0.403414 0.750000 O\n0.265974 0.390993 0.250000 O\n0.499558 0.846781 0.423286 O\n0.499558 0.846781 0.076714 O\n0.214182 0.270941 0.887288 O\n0.214182 0.270941 0.612712 O\n0.347223 0.500442 0.423286 O\n0.347223 0.500442 0.076714 O\n0.270941 0.214182 0.112712 O\n0.270941 0.214182 0.387288 O\n0.609007 0.874982 0.250000 O\n0.491288 0.653529 0.584221 O\n0.491288 0.653529 0.915779 O\n0.283921 0.058749 0.885135 O\n0.283921 0.058749 0.614865 O\n0.596586 0.740591 0.750000 O\n0.390993 0.265974 0.750000 O\n0.729059 0.943241 0.887288 O\n0.729059 0.943241 0.612712 O\n0.500442 0.347223 0.923286 O\n0.500442 0.347223 0.576714 O\n0.403414 0.144004 0.250000 O\n0.716079 0.774828 0.114865 O\n0.716079 0.774828 0.385135 O\n0.653529 0.491288 0.084221 O\n0.653529 0.491288 0.415779 O\n0.774828 0.716079 0.885135 O\n0.774828 0.716079 0.614865 O\n0.508712 0.162241 0.084221 O\n0.508712 0.162241 0.415779 O\n0.740591 0.596586 0.250000 O\n0.874982 0.609007 0.750000 O\n0.652777 0.153219 0.923286 O\n0.652777 0.153219 0.576714 O\n0.943241 0.729059 0.112712 O\n0.943241 0.729059 0.387288 O\n0.846781 0.499558 0.923286 O\n0.846781 0.499558 0.576714 O\n0.734026 0.125018 0.750000 O\n0.837759 0.346471 0.084221 O\n0.837759 0.346471 0.415779 O\n0.855996 0.259409 0.250000 O\n0.785818 0.056759 0.112712 O\n0.785818 0.056759 0.387288 O\n0.941251 0.225172 0.885135 O\n0.941251 0.225172 0.614865 O\n",
            "nsites": 98,
            "nelements": 4,
            "elements": [
                "Li",
                "Si",
                "Ni",
                "O"
            ],
            "chemical_system": "Li-Ni-O-Si",
            "density": 2.9085852940976427,
            "density_atomic": 0.07633514914917425,
            "volume": 1283.8122554589927,
            "volume_molar": 7.889079705905237,
            "formula_full": "Li4 Si24 Ni10 O60",
            "formula_reduced": "Li2Si12(NiO6)5",
            "formula_anonymous": "A2B5C12D30",
            "energy": -752.16667134,
            "energy_per_atom": -7.675170115714286,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -685.53667134,
            "band_gap": 4.3937,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.0082886,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:22.584000Z",
            "spacegroup": 190
        },
        {
            "id": "mp-1229043",
            "created_at": "2022-09-04T14:46:23.197202Z",
            "structure_string": "Ba8 Zn4 Cu2 Ge40\n1.0\n7.683661 -7.684174 0.000000\n7.683661 7.684174 0.000000\n0.000000 0.000000 10.872383\nBa Zn Cu Ge\n8 4 2 40\ndirect\n0.499490 0.999447 0.250000 Ba\n0.000553 0.500510 0.750000 Ba\n0.251766 0.998304 0.750000 Ba\n0.001696 0.748234 0.250000 Ba\n0.498351 0.501649 0.500000 Ba\n0.748288 0.998316 0.750000 Ba\n0.001684 0.251712 0.250000 Ba\n0.498351 0.501649 0.000000 Ba\n0.999830 0.000170 0.500000 Zn\n0.749774 0.499805 0.250000 Zn\n0.500195 0.250226 0.750000 Zn\n0.999830 0.000170 0.000000 Zn\n0.250046 0.499872 0.250000 Cu\n0.500128 0.749954 0.750000 Cu\n0.316985 0.816622 0.433792 Ge\n0.683716 0.183658 0.066252 Ge\n0.683716 0.183658 0.433748 Ge\n0.316985 0.816622 0.066208 Ge\n0.316828 0.183949 0.066447 Ge\n0.683526 0.816864 0.434010 Ge\n0.683526 0.816864 0.065990 Ge\n0.316828 0.183949 0.433553 Ge\n0.183378 0.683015 0.933792 Ge\n0.816342 0.316284 0.566252 Ge\n0.816342 0.316284 0.933748 Ge\n0.183378 0.683015 0.566208 Ge\n0.816051 0.683172 0.566447 Ge\n0.183136 0.316474 0.934010 Ge\n0.183136 0.316474 0.565990 Ge\n0.816051 0.683172 0.933553 Ge\n0.500016 0.878384 0.566273 Ge\n0.189274 0.000025 0.368459 Ge\n0.378247 0.683813 0.250000 Ge\n0.500007 0.116883 0.939701 Ge\n0.810802 0.000005 0.131946 Ge\n0.616632 0.310167 0.250000 Ge\n0.500007 0.116883 0.560299 Ge\n0.810802 0.000005 0.368054 Ge\n0.500016 0.878384 0.933727 Ge\n0.189274 0.000025 0.131541 Ge\n0.378625 0.316285 0.250000 Ge\n0.617082 0.689833 0.250000 Ge\n0.121616 0.499984 0.066273 Ge\n0.999975 0.810726 0.868459 Ge\n0.316187 0.621753 0.750000 Ge\n0.883117 0.499993 0.439701 Ge\n0.999995 0.189198 0.631946 Ge\n0.689833 0.383368 0.750000 Ge\n0.883117 0.499993 0.060299 Ge\n0.999995 0.189198 0.868054 Ge\n0.121616 0.499984 0.433727 Ge\n0.999975 0.810726 0.631541 Ge\n0.683715 0.621375 0.750000 Ge\n0.310167 0.382918 0.750000 Ge\n",
            "nsites": 54,
            "nelements": 4,
            "elements": [
                "Ba",
                "Zn",
                "Cu",
                "Ge"
            ],
            "chemical_system": "Ba-Cu-Ge-Zn",
            "density": 5.681782958497175,
            "density_atomic": 0.04206042291469777,
            "volume": 1283.8672618560383,
            "volume_molar": 14.317832163060817,
            "formula_full": "Ba8 Zn4 Cu2 Ge40",
            "formula_reduced": "Ba4Zn2CuGe20",
            "formula_anonymous": "AB2C4D20",
            "energy": -224.70518648,
            "energy_per_atom": -4.161207157037037,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -224.70518648,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0035669,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:34.284000Z",
            "spacegroup": 40
        },
        {
            "id": "mp-27102",
            "created_at": "2022-09-04T14:42:20.978967Z",
            "structure_string": "Fe8 P18 O64\n1.0\n14.164004 0.000000 0.000000\n0.000000 14.164004 0.000000\n0.000000 0.000000 6.399793\nFe P O\n8 18 64\ndirect\n0.301312 0.619095 0.874906 Fe\n0.880905 0.198688 0.374906 Fe\n0.119095 0.801312 0.374906 Fe\n0.698688 0.380905 0.874906 Fe\n0.380905 0.301312 0.125094 Fe\n0.619095 0.698688 0.125094 Fe\n0.198688 0.119095 0.625094 Fe\n0.801312 0.880905 0.625094 Fe\n0.892455 0.246746 0.864708 P\n0.940392 0.700266 0.616523 P\n0.700266 0.059608 0.383477 P\n0.246746 0.107545 0.135292 P\n0.200266 0.440392 0.116523 P\n0.799734 0.559608 0.116523 P\n0.500000 0.500000 0.000000 P\n0.440392 0.799734 0.883477 P\n0.392455 0.253254 0.635292 P\n0.299734 0.940392 0.383477 P\n0.559608 0.200266 0.883477 P\n0.753254 0.892455 0.135292 P\n0.746746 0.392455 0.364708 P\n0.607545 0.746746 0.635292 P\n0.107545 0.753254 0.864708 P\n0.000000 0.000000 0.500000 P\n0.059608 0.299734 0.616523 P\n0.253254 0.607545 0.364708 P\n0.662810 0.833670 0.125968 O\n0.060976 0.933945 0.360874 O\n0.759165 0.507199 0.927648 O\n0.500736 0.221025 0.672677 O\n0.000736 0.278975 0.827323 O\n0.333670 0.162810 0.625968 O\n0.817913 0.865603 0.318384 O\n0.278975 0.999264 0.172677 O\n0.337190 0.166330 0.125968 O\n0.182087 0.134397 0.318384 O\n0.365603 0.317913 0.818384 O\n0.837190 0.333670 0.374032 O\n0.106143 0.808122 0.068549 O\n0.843430 0.744852 0.649893 O\n0.134397 0.817913 0.681616 O\n0.606143 0.691878 0.431451 O\n0.166330 0.662810 0.874032 O\n0.156570 0.255148 0.649893 O\n0.571340 0.093087 0.906087 O\n0.928660 0.593087 0.593913 O\n0.071340 0.406913 0.593913 O\n0.906913 0.571340 0.093913 O\n0.740835 0.007199 0.572352 O\n0.778975 0.500736 0.327323 O\n0.259165 0.992801 0.572352 O\n0.240835 0.492801 0.927648 O\n0.939024 0.066055 0.360874 O\n0.093087 0.428660 0.093913 O\n0.933945 0.939024 0.639126 O\n0.666330 0.837190 0.625968 O\n0.560976 0.566055 0.139126 O\n0.865603 0.182087 0.681616 O\n0.406913 0.928660 0.406087 O\n0.308122 0.606143 0.568549 O\n0.343430 0.755148 0.850107 O\n0.244852 0.343430 0.149893 O\n0.893857 0.191878 0.068549 O\n0.634397 0.682087 0.818384 O\n0.999264 0.721025 0.827323 O\n0.191878 0.106143 0.931451 O\n0.007199 0.259165 0.427648 O\n0.808122 0.893857 0.931451 O\n0.593087 0.071340 0.406087 O\n0.691878 0.393857 0.568549 O\n0.507199 0.240835 0.072352 O\n0.428660 0.906913 0.906087 O\n0.833670 0.337190 0.874032 O\n0.755148 0.656570 0.149893 O\n0.682087 0.365603 0.181616 O\n0.393857 0.308122 0.431451 O\n0.656570 0.244852 0.850107 O\n0.162810 0.666330 0.374032 O\n0.721025 0.000736 0.172677 O\n0.439024 0.433945 0.139126 O\n0.317913 0.634397 0.181616 O\n0.492801 0.759165 0.072352 O\n0.433945 0.560976 0.860874 O\n0.066055 0.060976 0.639126 O\n0.566055 0.439024 0.860874 O\n0.221025 0.499264 0.327323 O\n0.255148 0.843430 0.350107 O\n0.744852 0.156570 0.350107 O\n0.499264 0.778975 0.672677 O\n0.992801 0.740835 0.427648 O\n",
            "nsites": 90,
            "nelements": 3,
            "elements": [
                "Fe",
                "P",
                "O"
            ],
            "chemical_system": "Fe-O-P",
            "density": 2.6232061819824155,
            "density_atomic": 0.07009781823229048,
            "volume": 1283.9201314619747,
            "volume_molar": 8.59105306251302,
            "formula_full": "Fe8 P18 O64",
            "formula_reduced": "Fe4P9O32",
            "formula_anonymous": "A4B9C32",
            "energy": -672.99280286,
            "energy_per_atom": -7.477697809555555,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -610.97680286,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 37.0216487,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:50.440000Z",
            "spacegroup": 114
        },
        {
            "id": "mp-1245292",
            "created_at": "2022-09-04T14:39:17.549772Z",
            "structure_string": "Ti39 O65\n1.0\n10.849975 0.150225 -0.130690\n0.141030 10.957948 0.039908\n-0.119023 0.040419 10.804587\nTi O\n39 65\ndirect\n0.418607 0.694162 0.901964 Ti\n0.694757 0.669812 0.552095 Ti\n0.615835 0.294181 0.379373 Ti\n0.600177 0.372786 0.641727 Ti\n0.220481 0.594880 0.073048 Ti\n0.294142 0.018514 0.917338 Ti\n0.762604 0.168685 0.078912 Ti\n0.821358 0.147666 0.557983 Ti\n0.578553 0.039082 0.701126 Ti\n0.172525 0.402523 0.546950 Ti\n0.921763 0.692662 0.086050 Ti\n0.350964 0.461814 0.364665 Ti\n0.599490 0.402377 0.904248 Ti\n0.068753 0.901506 0.182582 Ti\n0.814374 0.775698 0.319279 Ti\n0.907752 0.489301 0.486814 Ti\n0.567326 0.926673 0.469128 Ti\n0.208749 0.761615 0.754908 Ti\n0.372864 0.205821 0.503943 Ti\n0.913322 0.796283 0.679388 Ti\n0.808600 0.895276 0.930503 Ti\n0.762760 0.537513 0.226047 Ti\n0.087579 0.945227 0.443299 Ti\n0.029510 0.000022 0.927502 Ti\n0.610503 0.039552 0.258577 Ti\n0.677609 0.660339 0.994047 Ti\n0.957846 0.533304 0.762761 Ti\n0.060592 0.305481 0.017448 Ti\n0.532708 0.955885 0.958557 Ti\n0.431345 0.633987 0.554332 Ti\n0.044845 0.449130 0.271170 Ti\n0.391212 0.227695 0.754187 Ti\n0.316816 0.980441 0.216086 Ti\n0.133701 0.696765 0.333541 Ti\n0.266223 0.999011 0.636618 Ti\n0.361286 0.227582 0.110797 Ti\n0.100846 0.189066 0.362588 Ti\n0.852145 0.269869 0.862759 Ti\n0.501521 0.455935 0.133676 Ti\n0.852959 0.055088 0.990579 O\n0.182024 0.970647 0.056943 O\n0.828419 0.691960 0.914891 O\n0.846749 0.171777 0.719547 O\n0.711335 0.919011 0.331895 O\n0.964709 0.126332 0.474732 O\n0.665085 0.952814 0.835426 O\n0.536394 0.767269 0.526623 O\n0.534817 0.203163 0.643402 O\n0.563701 0.589264 0.874294 O\n0.465733 0.939888 0.307837 O\n0.047751 0.043820 0.273675 O\n0.078024 0.291770 0.203456 O\n0.438193 0.988125 0.591343 O\n0.018526 0.352936 0.426115 O\n0.409049 0.047837 0.073475 O\n0.278141 0.133568 0.255816 O\n0.241860 0.311131 0.409429 O\n0.234382 0.233808 0.005325 O\n0.387342 0.357584 0.227651 O\n0.846091 0.589933 0.633991 O\n0.489541 0.319101 0.023466 O\n0.746969 0.714945 0.162724 O\n0.270982 0.536665 0.522073 O\n0.275286 0.309971 0.644140 O\n0.026649 0.586116 0.412618 O\n0.211114 0.843069 0.580615 O\n0.706441 0.187609 0.251761 O\n0.646076 0.015532 0.090001 O\n0.101331 0.710843 0.147489 O\n0.208177 0.535886 0.264756 O\n0.890105 0.273263 0.062877 O\n0.254155 0.113361 0.769721 O\n0.215746 0.864320 0.306529 O\n0.546357 0.782684 0.005271 O\n0.386800 0.872833 0.868717 O\n0.737197 0.304781 0.515380 O\n0.745227 0.796769 0.650869 O\n0.472400 0.361417 0.477189 O\n0.432415 0.606652 0.379519 O\n0.237212 0.686578 0.924048 O\n0.927310 0.523853 0.158467 O\n0.049444 0.681749 0.746695 O\n0.029239 0.440276 0.642247 O\n0.953613 0.863868 0.043171 O\n0.728285 0.388140 0.769502 O\n0.028039 0.170262 0.901937 O\n0.776624 0.613273 0.399412 O\n0.690187 0.243357 0.938221 O\n0.957977 0.410661 0.885507 O\n0.364459 0.676564 0.720792 O\n0.399508 0.583678 0.067688 O\n0.673657 0.492898 0.061810 O\n0.470161 0.090446 0.849701 O\n0.211720 0.088300 0.492668 O\n0.622864 0.435148 0.279140 O\n0.477334 0.379998 0.780317 O\n0.162710 0.919548 0.816507 O\n0.923033 0.915312 0.801288 O\n0.144683 0.463017 0.027458 O\n0.691513 0.029464 0.556204 O\n0.518616 0.150587 0.383211 O\n0.986513 0.820085 0.331573 O\n0.578353 0.543792 0.598981 O\n0.969543 0.882169 0.556505 O\n",
            "nsites": 104,
            "nelements": 2,
            "elements": [
                "Ti",
                "O"
            ],
            "chemical_system": "O-Ti",
            "density": 3.7586827368306595,
            "density_atomic": 0.0809857566568522,
            "volume": 1284.1764316738104,
            "volume_molar": 7.436049261744432,
            "formula_full": "Ti39 O65",
            "formula_reduced": "Ti3O5",
            "formula_anonymous": "A3B5",
            "energy": -960.33506071,
            "energy_per_atom": -9.233990968365385,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -915.68006071,
            "band_gap": 0.0350999999999999,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 6.0016178,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:43.080000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-37167",
            "created_at": "2022-09-04T14:42:13.427578Z",
            "structure_string": "U12 Rh4 Se31\n1.0\n-6.842508 6.842508 6.857255\n6.842508 -6.842508 6.857255\n6.842508 6.842508 -6.857255\nU Rh Se\n12 4 31\ndirect\n0.705162 0.000859 0.295696 U\n0.294838 0.590534 0.295696 U\n0.699501 0.699501 0.399002 U\n0.409466 0.705162 0.704304 U\n0.000859 0.705162 0.295696 U\n0.300499 0.699501 0.000000 U\n0.590534 0.294838 0.295696 U\n0.300499 0.300499 0.600998 U\n0.705162 0.409466 0.704304 U\n0.999141 0.294838 0.704304 U\n0.699501 0.300499 0.000000 U\n0.294838 0.999141 0.704304 U\n0.000000 0.000000 0.500000 Rh\n0.500000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.437366 0.999518 0.182170 Se\n0.182652 0.000482 0.437848 Se\n0.182652 0.744805 0.182170 Se\n0.817348 0.999518 0.562152 Se\n0.500000 0.763042 0.263042 Se\n0.250000 0.750000 0.500000 Se\n0.811495 0.811495 0.251639 Se\n0.255195 0.817348 0.817830 Se\n0.562634 0.744805 0.562152 Se\n0.999518 0.817348 0.562152 Se\n0.559856 0.811495 0.000000 Se\n0.000482 0.562634 0.817830 Se\n0.440144 0.440144 0.251639 Se\n0.255195 0.437366 0.437848 Se\n0.763042 0.500000 0.263042 Se\n0.236958 0.500000 0.736958 Se\n0.744805 0.562634 0.562152 Se\n0.559856 0.559856 0.748361 Se\n0.999518 0.437366 0.182170 Se\n0.188505 0.440144 0.000000 Se\n0.500000 0.500000 0.000000 Se\n0.437366 0.255195 0.437848 Se\n0.811495 0.559856 0.000000 Se\n0.744805 0.182652 0.182170 Se\n0.188505 0.188505 0.748361 Se\n0.750000 0.250000 0.500000 Se\n0.500000 0.236958 0.736958 Se\n0.817348 0.255195 0.817830 Se\n0.000482 0.182652 0.437848 Se\n0.440144 0.188505 0.000000 Se\n0.562634 0.000482 0.817830 Se\n",
            "nsites": 47,
            "nelements": 3,
            "elements": [
                "U",
                "Rh",
                "Se"
            ],
            "chemical_system": "Rh-Se-U",
            "density": 7.390601774200091,
            "density_atomic": 0.03659796513641892,
            "volume": 1284.22440495824,
            "volume_molar": 16.45485134911865,
            "formula_full": "U12 Rh4 Se31",
            "formula_reduced": "U12Rh4Se31",
            "formula_anonymous": "A4B12C31",
            "energy": -336.22583853000003,
            "energy_per_atom": -7.15374124531915,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -321.59383853,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 22.0012927,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:36.899000Z",
            "spacegroup": 139
        },
        {
            "id": "mp-560901",
            "created_at": "2022-09-04T14:46:38.221566Z",
            "structure_string": "Pd16 S16 Cl16\n1.0\n9.644818 0.000000 0.000000\n0.000000 9.254538 0.000000\n0.000000 8.768723 14.388024\nPd S Cl\n16 16 16\ndirect\n0.206748 0.957292 0.017652 Pd\n0.094682 0.922442 0.678381 Pd\n0.293252 0.957292 0.517652 Pd\n0.594682 0.077558 0.821619 Pd\n0.879844 0.690928 0.639280 Pd\n0.922097 0.273637 0.521544 Pd\n0.379844 0.309072 0.860720 Pd\n0.905318 0.077558 0.321619 Pd\n0.706748 0.042708 0.482348 Pd\n0.077903 0.726363 0.478456 Pd\n0.120156 0.309072 0.360720 Pd\n0.793252 0.042708 0.982348 Pd\n0.422097 0.726363 0.978456 Pd\n0.405318 0.922442 0.178381 Pd\n0.620156 0.690928 0.139280 Pd\n0.577903 0.273637 0.021544 Pd\n0.404289 0.587231 0.137670 S\n0.653960 0.665318 0.012061 S\n0.265086 0.737094 0.163478 S\n0.234914 0.737094 0.663478 S\n0.904289 0.412769 0.362330 S\n0.595711 0.412769 0.862330 S\n0.765086 0.262906 0.336522 S\n0.846040 0.665318 0.512061 S\n0.095711 0.587231 0.637670 S\n0.762858 0.887182 0.912920 S\n0.262858 0.112818 0.587080 S\n0.734914 0.262906 0.836522 S\n0.346040 0.334682 0.987939 S\n0.153960 0.334682 0.487939 S\n0.237142 0.112818 0.087080 S\n0.737142 0.887182 0.412920 S\n0.064739 0.298105 0.225708 Cl\n0.964075 0.136031 0.684814 Cl\n0.322491 0.771802 0.459795 Cl\n0.677509 0.228198 0.540205 Cl\n0.822491 0.228198 0.040205 Cl\n0.650624 0.796917 0.628339 Cl\n0.935261 0.701895 0.774292 Cl\n0.849376 0.796917 0.128339 Cl\n0.349376 0.203083 0.371661 Cl\n0.177509 0.771802 0.959795 Cl\n0.435261 0.298105 0.725708 Cl\n0.535925 0.136031 0.184814 Cl\n0.035925 0.863969 0.315186 Cl\n0.464075 0.863969 0.815186 Cl\n0.150624 0.203083 0.871661 Cl\n0.564739 0.701895 0.274292 Cl\n",
            "nsites": 48,
            "nelements": 3,
            "elements": [
                "Pd",
                "S",
                "Cl"
            ],
            "chemical_system": "Cl-Pd-S",
            "density": 3.5984346400136222,
            "density_atomic": 0.03737586943389727,
            "volume": 1284.251061634633,
            "volume_molar": 16.112376384048325,
            "formula_full": "Pd16 S16 Cl16",
            "formula_reduced": "PdSCl",
            "formula_anonymous": "ABC",
            "energy": -215.84618825,
            "energy_per_atom": -4.496795588541667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -197.97418825,
            "band_gap": 0.8484999999999999,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0020629,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:42.885000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1042672",
            "created_at": "2022-09-04T14:44:30.469020Z",
            "structure_string": "Co8 Bi16 O56\n1.0\n17.218824 0.000000 0.000000\n0.000000 7.781398 0.000000\n0.000000 3.759478 9.584969\nCo Bi O\n8 16 56\ndirect\n0.684251 0.364810 0.076293 Co\n0.184251 0.635190 0.423707 Co\n0.315749 0.635190 0.923707 Co\n0.815749 0.364810 0.576293 Co\n0.755319 0.020097 0.245004 Co\n0.255319 0.979903 0.254996 Co\n0.244681 0.979903 0.754996 Co\n0.744681 0.020097 0.745004 Co\n0.847798 0.202302 0.919916 Bi\n0.001091 0.496681 0.733867 Bi\n0.498909 0.496681 0.233867 Bi\n0.998909 0.503319 0.266133 Bi\n0.703763 0.542119 0.748068 Bi\n0.203763 0.457881 0.751932 Bi\n0.296237 0.457881 0.251932 Bi\n0.796237 0.542119 0.248068 Bi\n0.501091 0.503319 0.766133 Bi\n0.140169 0.154836 0.428906 Bi\n0.640169 0.845164 0.071094 Bi\n0.859831 0.845164 0.571094 Bi\n0.347798 0.797698 0.580084 Bi\n0.652202 0.202302 0.419916 Bi\n0.152202 0.797698 0.080084 Bi\n0.359831 0.154836 0.928906 Bi\n0.958843 0.298720 0.935480 O\n0.458843 0.701280 0.564520 O\n0.041157 0.701280 0.064520 O\n0.541157 0.298720 0.435480 O\n0.810608 0.958651 0.887730 O\n0.310608 0.041349 0.612270 O\n0.189392 0.041349 0.112270 O\n0.689392 0.958651 0.387730 O\n0.840330 0.030245 0.133120 O\n0.340330 0.969755 0.366880 O\n0.159670 0.969755 0.866880 O\n0.659670 0.030245 0.633120 O\n0.291840 0.403729 0.919148 O\n0.791840 0.596271 0.580852 O\n0.708160 0.596271 0.080852 O\n0.208160 0.403729 0.419148 O\n0.347620 0.036072 0.148238 O\n0.847620 0.963928 0.351762 O\n0.652380 0.963928 0.851762 O\n0.152380 0.036072 0.648238 O\n0.314788 0.886890 0.902857 O\n0.394815 0.666542 0.802548 O\n0.814788 0.113110 0.597143 O\n0.185212 0.886890 0.402857 O\n0.435380 0.271467 0.746222 O\n0.935380 0.728533 0.753778 O\n0.564620 0.728533 0.253778 O\n0.064620 0.271467 0.246222 O\n0.472278 0.261656 0.964575 O\n0.972278 0.738344 0.535425 O\n0.527722 0.738344 0.035425 O\n0.027722 0.261656 0.464575 O\n0.895649 0.557364 0.129985 O\n0.395649 0.442636 0.370015 O\n0.104351 0.442636 0.870015 O\n0.604351 0.557364 0.629985 O\n0.750350 0.270692 0.235631 O\n0.250350 0.729308 0.264369 O\n0.249650 0.729308 0.764369 O\n0.749650 0.270692 0.735631 O\n0.729078 0.411035 0.443673 O\n0.229078 0.588965 0.056327 O\n0.270922 0.588965 0.556327 O\n0.770922 0.411035 0.943673 O\n0.732617 0.786042 0.239515 O\n0.232617 0.213958 0.260485 O\n0.267383 0.213958 0.760485 O\n0.767383 0.786042 0.739515 O\n0.878387 0.467158 0.414475 O\n0.378387 0.532842 0.085525 O\n0.121613 0.532842 0.585525 O\n0.621613 0.467158 0.914475 O\n0.105185 0.666542 0.302548 O\n0.605185 0.333458 0.197452 O\n0.894815 0.333458 0.697452 O\n0.685212 0.113110 0.097143 O\n",
            "nsites": 80,
            "nelements": 3,
            "elements": [
                "Co",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-Co-O",
            "density": 6.091458422585129,
            "density_atomic": 0.06229284388800163,
            "volume": 1284.2566658833982,
            "volume_molar": 9.667468017397642,
            "formula_full": "Co8 Bi16 O56",
            "formula_reduced": "CoBi2O7",
            "formula_anonymous": "AB2C7",
            "energy": -475.04550373,
            "energy_per_atom": -5.938068796625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -423.46950373,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 15.9141056,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:41.078000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-683918",
            "created_at": "2022-09-04T14:41:53.650640Z",
            "structure_string": "Rb12 C24 N36\n1.0\n12.468667 0.000000 0.000000\n0.000000 4.042925 0.000000\n0.000000 3.341298 25.480085\nRb C N\n12 24 36\ndirect\n0.152455 0.526179 0.012517 Rb\n0.092726 0.569519 0.399550 Rb\n0.592726 0.430481 0.100450 Rb\n0.407274 0.569519 0.899550 Rb\n0.511203 0.565272 0.259050 Rb\n0.907274 0.430481 0.600450 Rb\n0.847545 0.473821 0.987483 Rb\n0.347545 0.526179 0.512517 Rb\n0.488797 0.434728 0.740950 Rb\n0.652455 0.473821 0.487483 Rb\n0.988797 0.565272 0.759050 Rb\n0.011203 0.434728 0.240950 Rb\n0.326900 0.000584 0.121095 C\n0.242732 0.102578 0.792685 C\n0.826900 0.999416 0.378905 C\n0.998274 0.048064 0.901858 C\n0.790972 0.960318 0.292906 C\n0.173100 0.000584 0.621095 C\n0.001726 0.951936 0.098142 C\n0.130376 0.998020 0.534046 C\n0.257268 0.102578 0.292685 C\n0.369624 0.998020 0.034046 C\n0.347404 0.001484 0.649454 C\n0.152596 0.001484 0.149454 C\n0.757268 0.897422 0.207315 C\n0.673100 0.999416 0.878905 C\n0.709028 0.960318 0.792906 C\n0.209028 0.039682 0.707094 C\n0.630376 0.001980 0.965954 C\n0.742732 0.897422 0.707315 C\n0.652596 0.998516 0.350546 C\n0.869624 0.001980 0.465954 C\n0.498274 0.951936 0.598142 C\n0.501726 0.048064 0.401858 C\n0.847404 0.998516 0.850546 C\n0.290972 0.039682 0.207094 C\n0.683846 0.974045 0.300814 N\n0.828044 0.926287 0.243747 N\n0.866657 0.978280 0.330420 N\n0.220974 0.992714 0.108551 N\n0.454180 0.080451 0.441002 N\n0.301497 0.135716 0.827980 N\n0.848082 0.991929 0.511296 N\n0.133343 0.021720 0.669580 N\n0.955853 0.014332 0.856906 N\n0.183846 0.025955 0.199186 N\n0.401836 0.990252 0.082144 N\n0.598164 0.009748 0.917856 N\n0.348082 0.008071 0.988704 N\n0.098164 0.990252 0.582144 N\n0.316154 0.025955 0.699186 N\n0.651918 0.991929 0.011296 N\n0.698503 0.864284 0.172020 N\n0.279026 0.992714 0.608551 N\n0.954180 0.919549 0.058998 N\n0.366657 0.021720 0.169580 N\n0.171956 0.073713 0.756253 N\n0.816154 0.974045 0.800814 N\n0.779026 0.007286 0.891449 N\n0.455853 0.985668 0.643094 N\n0.633343 0.978280 0.830420 N\n0.045820 0.080451 0.941002 N\n0.544147 0.014332 0.356906 N\n0.328044 0.073713 0.256253 N\n0.198503 0.135716 0.327980 N\n0.151918 0.008071 0.488704 N\n0.801497 0.864284 0.672020 N\n0.720974 0.007286 0.391449 N\n0.044147 0.985668 0.143094 N\n0.545820 0.919549 0.558998 N\n0.901836 0.009748 0.417856 N\n0.671956 0.926287 0.743747 N\n",
            "nsites": 72,
            "nelements": 3,
            "elements": [
                "Rb",
                "C",
                "N"
            ],
            "chemical_system": "C-N-Rb",
            "density": 2.35046101045955,
            "density_atomic": 0.05605520081250792,
            "volume": 1284.448168169513,
            "volume_molar": 10.743232871723555,
            "formula_full": "Rb12 C24 N36",
            "formula_reduced": "RbC2N3",
            "formula_anonymous": "AB2C3",
            "energy": -560.85613203,
            "energy_per_atom": -7.789668500416667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -547.86013203,
            "band_gap": 3.653,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0002222,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:35.727000Z",
            "spacegroup": 14
        }
    ]
}