GET /third-parties/JarvisStructure/?format=api&ordering=nsites&page=4587
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 55712,
    "next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=4588",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=4586",
    "results": [
        {
            "id": "jvasp-95486",
            "created_at": "2022-09-04T14:35:53.855932Z",
            "updated_at": "2022-09-04T14:35:53.855961Z",
            "structure_string": "Sr8 Si8 O24\n1.0\n6.114413 0.000000 0.000000\n0.000000 7.462506 -0.832849\n0.000000 -0.025375 12.165794\nSr Si O\n8 8 24\ndirect\n0.408112 0.584198 0.840683 Sr\n0.091888 0.084198 0.340683 Sr\n0.598893 0.910390 0.125606 Sr\n0.901107 0.410389 0.625606 Sr\n0.908112 0.915801 0.659317 Sr\n0.591887 0.415802 0.159317 Sr\n0.401107 0.089610 0.874394 Sr\n0.098893 0.589611 0.374394 Sr\n0.850757 0.331619 0.881390 Si\n0.088145 0.248527 0.092302 Si\n0.588144 0.251473 0.407698 Si\n0.411854 0.748527 0.592302 Si\n0.350757 0.168380 0.618610 Si\n0.911855 0.751472 0.907697 Si\n0.149243 0.668381 0.118610 Si\n0.649242 0.831620 0.381390 Si\n0.616941 0.657030 0.648037 O\n0.129105 0.148315 0.546671 O\n0.370895 0.648316 0.046671 O\n0.439388 0.773619 0.457551 O\n0.883059 0.157030 0.148037 O\n0.676092 0.701240 0.267830 O\n0.587199 0.037203 0.343732 O\n0.825673 0.344656 0.399307 O\n0.116941 0.842970 0.851962 O\n0.176092 0.798761 0.232170 O\n0.870894 0.851684 0.453329 O\n0.412800 0.962797 0.656267 O\n0.087199 0.462797 0.156267 O\n0.823907 0.201239 0.767829 O\n0.674326 0.844656 0.899307 O\n0.174326 0.655344 0.600692 O\n0.939388 0.726382 0.042449 O\n0.912800 0.537203 0.843732 O\n0.323908 0.298760 0.732170 O\n0.325673 0.155344 0.100693 O\n0.060612 0.273618 0.957551 O\n0.560612 0.226381 0.542449 O\n0.629105 0.351684 0.953329 O\n0.383059 0.342970 0.351963 O\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Sr",
                "Si",
                "O"
            ],
            "chemical_system": "O-Si-Sr",
            "density": 3.9184902035737474,
            "density_atomic": 0.07207442342707289,
            "volume": 554.9818936876162,
            "volume_molar": 8.35544770759545,
            "formula_full": "Sr8 Si8 O24",
            "formula_reduced": "SrSiO3",
            "formula_anonymous": "ABC3",
            "energy_above_hull": 1.4497330819999994,
            "spacegroup": 14
        },
        {
            "id": "jvasp-97814",
            "created_at": "2022-09-04T14:35:57.803261Z",
            "updated_at": "2022-09-04T14:35:57.803277Z",
            "structure_string": "Sn8 B4 F28\n1.0\n5.382598 0.000000 -0.003402\n0.000000 8.250981 0.000000\n0.009459 0.000000 13.995065\nSn B F\n8 4 28\ndirect\n0.249990 0.016769 0.190453 Sn\n0.750011 0.983231 0.809547 Sn\n0.749990 0.483231 0.690453 Sn\n0.750014 0.708684 0.052061 Sn\n0.749987 0.208684 0.447939 Sn\n0.249987 0.291316 0.947939 Sn\n0.250014 0.791316 0.552061 Sn\n0.250010 0.516769 0.309547 Sn\n0.750014 0.803301 0.375833 B\n0.749987 0.303302 0.124167 B\n0.249987 0.196698 0.624167 B\n0.250014 0.696698 0.875833 B\n0.499051 0.825098 0.149222 F\n0.749987 0.781963 0.476862 F\n0.750014 0.281963 0.023138 F\n0.250013 0.218037 0.523138 F\n0.966822 0.891566 0.350944 F\n0.533179 0.391566 0.149056 F\n0.033179 0.108434 0.649056 F\n0.466822 0.608434 0.850944 F\n0.250004 0.849267 0.829922 F\n0.249997 0.349267 0.670078 F\n0.749997 0.150733 0.170078 F\n0.000949 0.325098 0.350778 F\n0.750004 0.650733 0.329922 F\n0.033241 0.608407 0.850935 F\n0.533241 0.891593 0.350935 F\n0.966759 0.391593 0.149065 F\n0.249987 0.718037 0.976862 F\n0.499053 0.325086 0.350771 F\n-0.000947 0.174914 0.850770 F\n0.500947 0.674913 0.649229 F\n0.249983 0.081228 0.038459 F\n0.250018 0.581228 0.461541 F\n0.750018 0.918772 0.961541 F\n0.749983 0.418772 0.538458 F\n0.500949 0.174902 0.850778 F\n0.999052 0.674902 0.649222 F\n0.466759 0.108407 0.649065 F\n0.000947 0.825086 0.149229 F\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Sn",
                "B",
                "F"
            ],
            "chemical_system": "B-F-Sn",
            "density": 4.0739146426304815,
            "density_atomic": 0.06435574959394917,
            "volume": 621.5450873057791,
            "volume_molar": 9.357580011104726,
            "formula_full": "Sn8 B4 F28",
            "formula_reduced": "Sn2BF7",
            "formula_anonymous": "AB2C7",
            "energy_above_hull": 0.2466167960833334,
            "spacegroup": 62
        },
        {
            "id": "jvasp-97372",
            "created_at": "2022-09-04T14:36:01.706333Z",
            "updated_at": "2022-09-04T14:36:01.706362Z",
            "structure_string": "Na16 Be8 O16\n1.0\n5.300912 0.000000 0.000000\n0.000000 7.772911 -1.224938\n0.000000 0.059079 11.439631\nNa Be O\n16 8 16\ndirect\n0.443226 0.661159 0.485103 Na\n0.558596 0.838861 0.014877 Na\n0.058597 0.161139 0.985123 Na\n0.948624 0.697660 0.624443 Na\n0.448624 0.302340 0.375557 Na\n0.382257 0.497023 0.918164 Na\n0.882256 0.502977 0.081835 Na\n0.119605 0.996998 0.418196 Na\n0.619605 0.003002 0.581804 Na\n0.168291 0.070497 0.715463 Na\n0.668291 0.929503 0.284537 Na\n0.333573 0.570445 0.215457 Na\n0.833572 0.429555 0.784543 Na\n0.053273 0.802323 0.875528 Na\n0.553273 0.197678 0.124471 Na\n0.943225 0.338841 0.514897 Na\n0.618424 0.134574 0.872710 Be\n0.118424 0.865426 0.127289 Be\n0.883386 0.634499 0.372718 Be\n0.383386 0.365501 0.627282 Be\n0.543384 0.879339 0.788610 Be\n0.043385 0.120661 0.211390 Be\n0.458538 0.620738 0.711368 Be\n0.958538 0.379262 0.288632 Be\n0.193427 0.693470 0.055507 O\n0.227175 0.479576 0.728178 O\n0.727174 0.520424 0.271822 O\n0.693427 0.306530 0.944493 O\n0.274650 0.979464 0.228198 O\n0.884873 0.981444 0.108583 O\n0.384873 0.018556 0.891416 O\n0.616978 0.481490 0.608575 O\n0.635337 0.696051 0.826898 O\n0.135337 0.303949 0.173101 O\n0.366565 0.804021 0.673075 O\n0.866565 0.195979 0.326925 O\n0.116978 0.518510 0.391425 O\n0.308414 0.193525 0.555520 O\n0.774650 0.020536 0.771801 O\n0.808414 0.806475 0.444480 O\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Na",
                "Be",
                "O"
            ],
            "chemical_system": "Be-Na-O",
            "density": 2.4496915036766733,
            "density_atomic": 0.08479307264657604,
            "volume": 471.7366496048921,
            "volume_molar": 7.102161263928646,
            "formula_full": "Na16 Be8 O16",
            "formula_reduced": "Na2BeO2",
            "formula_anonymous": "AB2C2",
            "energy_above_hull": 0.6882402199999997,
            "spacegroup": 14
        },
        {
            "id": "jvasp-20180",
            "created_at": "2022-09-04T14:38:34.642245Z",
            "updated_at": "2022-09-04T14:38:34.642260Z",
            "structure_string": "Tl16 O24\n1.0\n8.761229 0.000000 -3.097562\n-4.380614 7.587447 -3.097562\n-0.000000 -0.000000 9.292686\nTl O\n16 24\ndirect\n0.250001 0.717737 0.467738 Tl\n0.500000 0.500000 0.500001 Tl\n0.000000 0.000000 0.500000 Tl\n0.500000 -0.000000 0.000000 Tl\n0.000000 0.500000 0.000000 Tl\n0.250000 0.217737 0.967737 Tl\n0.532264 0.750000 0.282264 Tl\n0.282264 0.532263 0.750001 Tl\n0.967737 0.250000 0.217737 Tl\n0.750000 0.282263 0.532264 Tl\n0.750001 0.782263 0.032264 Tl\n0.717737 0.467737 0.250001 Tl\n0.467737 0.250000 0.717737 Tl\n0.782263 0.032263 0.750001 Tl\n0.217738 0.967737 0.250001 Tl\n0.032264 0.750000 0.782264 Tl\n0.228671 0.457406 0.463410 O\n0.036591 0.493996 0.765261 O\n0.228735 0.271330 0.734740 O\n0.271265 0.006004 0.042595 O\n0.536591 0.771330 0.542595 O\n0.271330 0.734740 0.228736 O\n0.993997 0.957406 0.728736 O\n0.265261 0.771265 0.728671 O\n0.506004 0.234740 0.963410 O\n0.957406 0.728735 0.993997 O\n0.728671 0.265261 0.771265 O\n0.234740 0.963410 0.506005 O\n0.542595 0.536590 0.771330 O\n0.765261 0.036590 0.493996 O\n0.771330 0.542595 0.536591 O\n0.771265 0.728671 0.265261 O\n0.963410 0.506004 0.234740 O\n0.463410 0.228670 0.457406 O\n0.006004 0.042594 0.271265 O\n0.734740 0.228735 0.271330 O\n0.493996 0.765261 0.036591 O\n0.042595 0.271265 0.006004 O\n0.728736 0.993996 0.957407 O\n0.457406 0.463410 0.228671 O\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "Tl",
                "O"
            ],
            "chemical_system": "O-Tl",
            "density": 9.82267438182488,
            "density_atomic": 0.06475272151820545,
            "volume": 617.7346536508719,
            "volume_molar": 9.300212591538497,
            "formula_full": "Tl16 O24",
            "formula_reduced": "Tl2O3",
            "formula_anonymous": "A2B3",
            "energy_above_hull": 1.11201114,
            "spacegroup": 206
        },
        {
            "id": "jvasp-20116",
            "created_at": "2022-09-04T14:38:40.003365Z",
            "updated_at": "2022-09-04T14:38:40.003392Z",
            "structure_string": "Tb16 O24\n1.0\n8.747893 0.000000 -3.092847\n-4.373947 7.575898 -3.092847\n-0.000000 -0.000000 9.278542\nTb O\n16 24\ndirect\n0.499982 0.499983 0.499982 Tb\n0.750000 0.782007 0.032006 Tb\n0.467993 0.250000 0.717993 Tb\n0.717993 0.467994 0.250000 Tb\n0.032006 0.750000 0.782006 Tb\n0.782006 0.032007 0.749999 Tb\n0.750000 0.282018 0.532018 Tb\n0.250000 0.717994 0.467993 Tb\n0.217982 0.967982 0.250000 Tb\n0.532018 0.750000 0.282018 Tb\n0.282018 0.532018 0.750000 Tb\n0.250000 0.217982 0.967981 Tb\n0.000017 0.500000 -0.000000 Tb\n0.500000 -0.000000 0.000017 Tb\n0.967981 0.250000 0.217981 Tb\n0.000000 0.000017 0.500000 Tb\n0.270550 0.739948 0.227988 O\n0.229449 0.457438 0.469397 O\n0.011960 0.042563 0.272012 O\n0.030603 0.488041 0.760052 O\n0.729469 0.260065 0.772031 O\n0.227988 0.270551 0.739947 O\n0.988033 0.957437 0.727967 O\n0.511967 0.239935 0.969404 O\n0.542563 0.530595 0.770530 O\n0.530595 0.770531 0.542563 O\n0.772031 0.729470 0.260064 O\n0.957436 0.727968 0.988032 O\n0.969404 0.511967 0.239934 O\n0.488040 0.760053 0.030603 O\n0.260065 0.772032 0.729469 O\n0.239935 0.969405 0.511966 O\n0.770530 0.542563 0.530595 O\n0.042563 0.272012 0.011960 O\n0.760052 0.030603 0.488040 O\n0.739947 0.227988 0.270550 O\n0.469397 0.229449 0.457437 O\n0.457437 0.469397 0.229449 O\n0.727968 0.988034 0.957436 O\n0.272012 0.011960 0.042562 O\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "Tb",
                "O"
            ],
            "chemical_system": "O-Tb",
            "density": 7.903573910391188,
            "density_atomic": 0.06504930671089576,
            "volume": 614.918160123911,
            "volume_molar": 9.257809290366028,
            "formula_full": "Tb16 O24",
            "formula_reduced": "Tb2O3",
            "formula_anonymous": "A2B3",
            "energy_above_hull": 1.38802346,
            "spacegroup": 206
        },
        {
            "id": "jvasp-21045",
            "created_at": "2022-09-04T14:38:34.370810Z",
            "updated_at": "2022-09-04T14:38:34.370834Z",
            "structure_string": "Zn8 Se8 O24\n1.0\n6.261640 -0.000000 0.000000\n-0.000000 7.175826 0.000000\n0.000000 0.000000 12.139121\nZn Se O\n8 8 24\ndirect\n0.863043 0.393070 0.595069 Zn\n0.363043 0.606931 0.904931 Zn\n0.636957 0.893070 0.404931 Zn\n0.136957 0.106931 0.095069 Zn\n0.136957 0.606931 0.404931 Zn\n0.636957 0.393070 0.095069 Zn\n0.363043 0.106931 0.595069 Zn\n0.863043 0.893070 0.904931 Zn\n0.888778 0.450176 0.855554 Se\n0.388778 0.549825 0.644446 Se\n0.111222 0.049824 0.355554 Se\n0.611222 0.950176 0.144446 Se\n0.611222 0.450176 0.355554 Se\n0.388778 0.049824 0.855554 Se\n0.888778 0.950176 0.644446 Se\n0.111222 0.549825 0.144446 Se\n0.345673 0.539064 0.067602 O\n0.703419 0.038157 0.267348 O\n0.203419 0.961844 0.232652 O\n0.203419 0.461844 0.267348 O\n0.703419 0.538157 0.232652 O\n0.296581 0.961844 0.732652 O\n0.796581 0.038157 0.767348 O\n0.654327 0.960937 0.567602 O\n0.154327 0.039064 0.932398 O\n0.845673 0.460937 0.432398 O\n0.345673 0.039064 0.432398 O\n0.982922 0.849562 0.408533 O\n0.154327 0.539064 0.567602 O\n0.654327 0.460937 0.932398 O\n0.017078 0.150438 0.591467 O\n0.517078 0.849562 0.908533 O\n0.482922 0.650439 0.408533 O\n0.982922 0.349562 0.091467 O\n0.296581 0.461844 0.767348 O\n0.482922 0.150438 0.091467 O\n0.517078 0.349562 0.591467 O\n0.017078 0.650439 0.908533 O\n0.845673 0.960937 0.067602 O\n0.796581 0.538157 0.732652 O\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Zn",
                "Se",
                "O"
            ],
            "chemical_system": "O-Se-Zn",
            "density": 4.685143240183414,
            "density_atomic": 0.0733352465568386,
            "volume": 545.4403152377478,
            "volume_molar": 8.211795886351224,
            "formula_full": "Zn8 Se8 O24",
            "formula_reduced": "ZnSeO3",
            "formula_anonymous": "ABC3",
            "energy_above_hull": 1.2662528533333333,
            "spacegroup": 61
        },
        {
            "id": "jvasp-29653",
            "created_at": "2022-09-04T14:38:34.203815Z",
            "updated_at": "2022-09-04T14:38:34.203841Z",
            "structure_string": "Cu4 P16 Se16 I4\n1.0\n9.513112 -0.127664 -0.000000\n-2.050875 9.290291 0.000000\n-0.000000 0.000000 12.503787\nCu P Se I\n4 16 16 4\ndirect\n0.904991 0.095009 0.500000 Cu\n0.595009 0.404991 0.000000 Cu\n0.404991 0.595009 0.000000 Cu\n0.095008 0.904991 0.500000 Cu\n0.755783 0.540382 0.259888 P\n0.255784 0.040382 0.240113 P\n0.540382 0.755784 0.259888 P\n0.244216 0.459617 0.740113 P\n0.716152 0.353295 0.145840 P\n0.459617 0.244217 0.740113 P\n0.959617 0.744217 0.759888 P\n0.146705 0.783848 0.645840 P\n0.646706 0.283848 0.854160 P\n0.744216 0.959618 0.759888 P\n0.783848 0.146706 0.645840 P\n0.040382 0.255784 0.240113 P\n0.216152 0.853294 0.354160 P\n0.853294 0.216153 0.354160 P\n0.353294 0.716152 0.145840 P\n0.283847 0.646706 0.854160 P\n0.850752 0.446571 0.407281 Se\n0.553429 0.149248 0.592719 Se\n0.350752 0.946571 0.092719 Se\n0.016576 0.016576 0.190972 Se\n0.149248 0.553429 0.592719 Se\n0.946570 0.350752 0.092719 Se\n0.446570 0.850752 0.407281 Se\n0.983423 0.983424 0.809028 Se\n0.516576 0.516576 0.309028 Se\n0.349444 0.849445 0.750000 Se\n0.053429 0.649248 0.907281 Se\n0.649248 0.053430 0.907281 Se\n0.483423 0.483424 0.690972 Se\n0.650555 0.150556 0.250000 Se\n0.849444 0.349445 0.750000 Se\n0.150555 0.650555 0.250000 Se\n0.310623 0.310623 0.015165 I\n0.810623 0.810623 0.484835 I\n0.189377 0.189377 0.515166 I\n0.689377 0.689377 0.984835 I\n",
            "nsites": 40,
            "nelements": 4,
            "elements": [
                "Cu",
                "P",
                "Se",
                "I"
            ],
            "chemical_system": "Cu-I-P-Se",
            "density": 3.7990281545980915,
            "density_atomic": 0.036304043258098155,
            "volume": 1101.8056505614538,
            "volume_molar": 16.58807179461112,
            "formula_full": "Cu4 P16 Se16 I4",
            "formula_reduced": "CuP4Se4I",
            "formula_anonymous": "ABC4D4",
            "energy_above_hull": 1.9925072191666668,
            "spacegroup": 64
        },
        {
            "id": "jvasp-5581",
            "created_at": "2022-09-04T14:38:38.633485Z",
            "updated_at": "2022-09-04T14:38:38.633518Z",
            "structure_string": "Nb12 Ge4 Te24\n1.0\n6.540390 0.000000 0.000000\n0.000000 11.705028 0.000000\n0.000000 0.000000 14.225115\nNb Ge Te\n12 4 24\ndirect\n0.696362 0.969115 0.250000 Nb\n0.196362 0.530885 0.250000 Nb\n0.803638 0.469115 0.750000 Nb\n0.303638 0.030885 0.750000 Nb\n0.963695 0.314584 0.250000 Nb\n0.463695 0.185416 0.250000 Nb\n0.536305 0.814585 0.750000 Nb\n0.036305 0.685416 0.750000 Nb\n0.824984 0.167142 0.750000 Nb\n0.324984 0.332859 0.750000 Nb\n0.675016 0.667142 0.250000 Nb\n0.175016 0.832859 0.250000 Nb\n0.074515 0.075207 0.250000 Ge\n0.574515 0.424793 0.250000 Ge\n0.425485 0.575207 0.750000 Ge\n0.925485 0.924793 0.750000 Ge\n0.136163 0.493048 0.620122 Te\n0.636162 0.006952 0.879878 Te\n0.636162 0.006952 0.620122 Te\n0.136163 0.493048 0.879878 Te\n0.863837 0.506952 0.379878 Te\n0.363837 0.993048 0.120122 Te\n0.784930 0.160591 0.383430 Te\n0.284930 0.339409 0.116570 Te\n0.715070 0.660591 0.616570 Te\n0.215070 0.839409 0.883430 Te\n0.215070 0.839409 0.616570 Te\n0.145194 0.180959 0.616809 Te\n0.284930 0.339409 0.383430 Te\n0.784930 0.160591 0.116570 Te\n0.854805 0.819041 0.383191 Te\n0.354806 0.680959 0.116809 Te\n0.645194 0.319041 0.616809 Te\n0.145194 0.180959 0.883190 Te\n0.863837 0.506952 0.120122 Te\n0.645194 0.319041 0.883190 Te\n0.354806 0.680959 0.383191 Te\n0.854805 0.819041 0.116809 Te\n0.715070 0.660591 0.883430 Te\n0.363837 0.993048 0.379878 Te\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Nb",
                "Ge",
                "Te"
            ],
            "chemical_system": "Ge-Nb-Te",
            "density": 6.8126250366562395,
            "density_atomic": 0.036730606752563885,
            "volume": 1089.0100528276164,
            "volume_molar": 16.395429567957354,
            "formula_full": "Nb12 Ge4 Te24",
            "formula_reduced": "Nb3GeTe6",
            "formula_anonymous": "AB3C6",
            "energy_above_hull": 2.6816890749999995,
            "spacegroup": 62
        },
        {
            "id": "jvasp-20989",
            "created_at": "2022-09-04T14:38:39.945347Z",
            "updated_at": "2022-09-04T14:38:39.945376Z",
            "structure_string": "Ca6 Sn26 Rh8\n1.0\n9.825171 -0.000000 0.000000\n-0.000000 9.825171 0.000000\n0.000000 0.000000 9.825171\nCa Sn Rh\n6 26 8\ndirect\n0.250000 0.500000 0.000000 Ca\n0.750000 0.500000 0.000000 Ca\n0.500000 0.000000 0.250000 Ca\n0.500000 0.000000 0.750000 Ca\n0.000000 0.750000 0.500000 Ca\n0.000000 0.250000 0.500000 Ca\n0.305658 0.846516 0.000000 Sn\n0.000000 0.694342 0.846516 Sn\n0.000000 0.305658 0.846516 Sn\n0.000000 0.694342 0.153484 Sn\n0.805658 0.500000 0.346516 Sn\n0.346516 0.194342 0.500000 Sn\n0.653484 0.194342 0.500000 Sn\n0.846516 0.000000 0.694342 Sn\n0.500000 0.653484 0.805658 Sn\n0.500000 0.346516 0.194342 Sn\n0.194342 0.500000 0.346516 Sn\n0.846516 0.000000 0.305658 Sn\n0.694342 0.153484 0.000000 Sn\n0.000000 0.305658 0.153484 Sn\n0.694342 0.846516 0.000000 Sn\n0.305658 0.153484 0.000000 Sn\n0.153484 0.000000 0.305658 Sn\n0.805658 0.500000 0.653484 Sn\n0.194342 0.500000 0.653484 Sn\n0.346516 0.805658 0.500000 Sn\n0.653484 0.805658 0.500000 Sn\n0.500000 0.653484 0.194342 Sn\n0.500000 0.346516 0.805658 Sn\n0.153484 0.000000 0.694342 Sn\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.250000 0.750000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n0.250000 0.750000 0.750000 Rh\n0.250000 0.250000 0.750000 Rh\n0.750000 0.250000 0.750000 Rh\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.250000 Rh\n0.750000 0.250000 0.250000 Rh\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Ca",
                "Sn",
                "Rh"
            ],
            "chemical_system": "Ca-Rh-Sn",
            "density": 7.265990745779795,
            "density_atomic": 0.04217349936057082,
            "volume": 948.4629116975083,
            "volume_molar": 14.279442899704613,
            "formula_full": "Ca6 Sn26 Rh8",
            "formula_reduced": "Ca3Sn13Rh4",
            "formula_anonymous": "A3B4C13",
            "energy_above_hull": 0.967299768,
            "spacegroup": 223
        },
        {
            "id": "jvasp-30791",
            "created_at": "2022-09-04T14:38:40.415401Z",
            "updated_at": "2022-09-04T14:38:40.415430Z",
            "structure_string": "Mo12 O28\n1.0\n5.728480 0.000000 0.000000\n0.000000 11.443855 0.000000\n0.000000 0.000000 7.582662\nMo O\n12 28\ndirect\n0.249964 0.011681 0.249998 Mo\n0.750036 0.988319 0.750002 Mo\n0.250036 0.011681 0.749998 Mo\n0.249964 0.488319 0.249998 Mo\n0.250033 0.750000 0.750004 Mo\n0.750033 0.250000 0.749996 Mo\n0.749964 0.511681 0.250002 Mo\n0.249967 0.750000 0.250004 Mo\n0.250036 0.488319 0.749998 Mo\n0.750036 0.511681 0.750002 Mo\n0.749964 0.988319 0.250002 Mo\n0.749967 0.250000 0.249996 Mo\n0.750069 0.250000 0.499993 O\n0.003743 0.627699 0.750034 O\n0.249931 0.750000 0.500006 O\n0.749931 0.250000 0.999993 O\n0.250069 0.750000 0.000007 O\n0.249969 0.492899 0.499997 O\n0.750031 0.507101 0.500003 O\n0.749969 0.992898 0.000003 O\n0.249969 0.007101 0.499997 O\n0.749969 0.507101 0.000003 O\n0.503743 0.372301 0.749965 O\n0.250031 0.492899 -0.000003 O\n0.996257 0.127699 0.249966 O\n0.496329 0.627701 0.749972 O\n0.996257 0.372301 0.249966 O\n0.496257 0.627699 0.250034 O\n0.003743 0.872301 0.750034 O\n0.503743 0.127699 0.749965 O\n0.250031 0.007101 -0.000003 O\n0.996329 0.372299 0.750028 O\n0.503671 0.127701 0.250028 O\n0.003671 0.872298 0.249972 O\n0.503671 0.372299 0.250028 O\n0.003671 0.627701 0.249972 O\n0.496329 0.872298 0.749972 O\n0.996329 0.127701 0.750028 O\n0.496257 0.872301 0.250034 O\n0.750031 0.992898 0.500003 O\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "Mo",
                "O"
            ],
            "chemical_system": "Mo-O",
            "density": 5.342390092237334,
            "density_atomic": 0.0804686186523914,
            "volume": 497.0881900283654,
            "volume_molar": 7.483837626211111,
            "formula_full": "Mo12 O28",
            "formula_reduced": "Mo3O7",
            "formula_anonymous": "A3B7",
            "energy_above_hull": 3.968351219999999,
            "spacegroup": 65
        },
        {
            "id": "jvasp-27283",
            "created_at": "2022-09-04T14:38:31.878639Z",
            "updated_at": "2022-09-04T14:38:31.878666Z",
            "structure_string": "Ta4 Hg6 S2 O8 F20\n1.0\n8.919697 -0.114385 -2.032008\n-5.216729 7.236008 -2.032008\n0.055730 0.107181 10.197432\nTa Hg S O F\n4 6 2 8 20\ndirect\n0.374590 0.755384 0.109353 Ta\n0.646031 0.265236 0.890646 Ta\n0.505384 0.624589 0.609353 Ta\n0.015237 0.896031 0.390647 Ta\n0.565122 0.294172 0.299821 Hg\n0.989648 0.989648 -0.000001 Hg\n0.044172 0.815122 0.799821 Hg\n0.015300 0.244351 0.200178 Hg\n0.739648 0.239648 0.500000 Hg\n-0.005649 0.265300 0.700178 Hg\n0.150218 0.650218 0.500000 S\n0.400218 0.400218 -0.000000 S\n0.154233 0.778963 0.428368 O\n0.071452 0.652244 0.609698 O\n0.042544 0.461752 0.390301 O\n0.475865 0.600594 0.071631 O\n0.528963 0.404233 0.928368 O\n0.350594 0.725864 0.571631 O\n0.211752 0.292544 0.890301 O\n0.402244 0.321452 0.109699 O\n0.804004 0.678419 0.389675 F\n0.891307 0.009421 0.369151 F\n0.640271 0.522157 0.630848 F\n0.759421 0.141307 0.869151 F\n0.272157 0.890271 0.130848 F\n0.234783 0.095292 0.386448 F\n0.708844 0.848335 0.613551 F\n0.251754 0.660954 0.900101 F\n0.760853 0.351652 0.099898 F\n0.410955 0.501754 0.400101 F\n0.101652 0.010853 0.599898 F\n0.490653 0.838517 0.316713 F\n0.521802 0.173939 0.683286 F\n0.588517 0.740652 0.816713 F\n0.923939 0.771802 0.183286 F\n0.164329 0.538744 0.110324 F\n0.428419 0.054004 0.889675 F\n0.288744 0.414328 0.610324 F\n0.845292 0.484782 0.886447 F\n0.598335 0.958844 0.113552 F\n",
            "nsites": 40,
            "nelements": 5,
            "elements": [
                "Ta",
                "Hg",
                "S",
                "O",
                "F"
            ],
            "chemical_system": "F-Hg-O-S-Ta",
            "density": 6.326826784330803,
            "density_atomic": 0.060975696034460326,
            "volume": 655.9990717841754,
            "volume_molar": 9.876296871784122,
            "formula_full": "Ta4 Hg6 S2 O8 F20",
            "formula_reduced": "Ta2Hg3S(O2F5)2",
            "formula_anonymous": "AB2C3D4E10",
            "energy_above_hull": 1.0489314512499996,
            "spacegroup": 43
        },
        {
            "id": "jvasp-20113",
            "created_at": "2022-09-04T14:38:34.627521Z",
            "updated_at": "2022-09-04T14:38:34.627547Z",
            "structure_string": "Nd16 O24\n1.0\n9.116428 -0.000000 -3.223143\n-4.558214 7.895058 -3.223143\n-0.000000 -0.000000 9.669431\nNd O\n16 24\ndirect\n0.500000 0.500000 0.500000 Nd\n0.250000 0.719541 0.469542 Nd\n0.030459 0.750000 0.780459 Nd\n0.780459 0.030459 0.750000 Nd\n0.469542 0.250000 0.719542 Nd\n0.719542 0.469541 0.250001 Nd\n0.750000 0.280459 0.530459 Nd\n0.750001 0.780459 0.030459 Nd\n0.219542 0.969542 0.250001 Nd\n0.530459 0.750000 0.280459 Nd\n0.280459 0.530459 0.750000 Nd\n0.250000 0.219541 0.969541 Nd\n0.000000 0.500000 0.000000 Nd\n0.500000 0.000000 0.000000 Nd\n0.969542 0.250000 0.219542 Nd\n0.000000 0.000000 0.500000 Nd\n0.959353 0.728716 0.987661 O\n0.540648 0.528308 0.769364 O\n0.241056 0.971692 0.512340 O\n0.730636 0.258944 0.771284 O\n0.028308 0.487661 0.758945 O\n0.987661 0.959352 0.728717 O\n0.228716 0.269364 0.741056 O\n0.271284 0.012340 0.040648 O\n0.230636 0.459352 0.471692 O\n0.459353 0.471692 0.230637 O\n0.758945 0.028308 0.487661 O\n0.269364 0.741056 0.228717 O\n0.040648 0.271284 0.012340 O\n0.258945 0.771284 0.730637 O\n0.487661 0.758945 0.028309 O\n0.012340 0.040648 0.271284 O\n0.471692 0.230636 0.459353 O\n0.971692 0.512340 0.241056 O\n0.771284 0.730636 0.258945 O\n0.728717 0.987661 0.959353 O\n0.769364 0.540648 0.528309 O\n0.528309 0.769364 0.540648 O\n0.741056 0.228716 0.269364 O\n0.512340 0.241056 0.971692 O\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "Nd",
                "O"
            ],
            "chemical_system": "Nd-O",
            "density": 6.4227383414810575,
            "density_atomic": 0.05747500814369138,
            "volume": 695.9546643298826,
            "volume_molar": 10.477842377932761,
            "formula_full": "Nd16 O24",
            "formula_reduced": "Nd2O3",
            "formula_anonymous": "A2B3",
            "energy_above_hull": 1.6285447,
            "spacegroup": 206
        }
    ]
}