GET /third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=551
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=-formula_full&page=552",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=550",
    "results": [
        {
            "id": "jvasp-91346",
            "created_at": "2022-09-04T14:36:12.801886Z",
            "updated_at": "2022-09-04T14:36:12.801920Z",
            "structure_string": "Tl16 Si4 Se16\n1.0\n6.936707 -0.019204 -0.914193\n-3.141073 6.249813 -0.165852\n-0.052306 0.003332 25.016677\nTl Si Se\n16 4 16\ndirect\n0.728551 0.349539 -0.000290 Tl\n0.271450 0.650461 0.000290 Tl\n0.150171 0.271159 0.499710 Tl\n0.433202 0.328382 0.321768 Tl\n0.506614 0.111434 0.178232 Tl\n0.566799 0.671618 0.678232 Tl\n0.493386 0.888566 0.821768 Tl\n0.103448 0.331746 0.164036 Tl\n0.667711 0.939412 0.335965 Tl\n0.896553 0.668254 0.835965 Tl\n0.332289 0.060588 0.664036 Tl\n0.000000 0.000000 0.000000 Tl\n0.500000 0.000000 0.500000 Tl\n0.082087 0.832087 0.250000 Tl\n0.917913 0.167913 0.750000 Tl\n0.849829 0.728840 0.500290 Tl\n0.935527 0.440383 0.623479 Si\n0.683097 0.687952 0.123479 Si\n0.064473 0.559617 0.376521 Si\n0.316903 0.312047 0.876521 Si\n0.609472 0.417687 0.582931 Se\n0.014418 0.604176 0.709904 Se\n0.018153 0.710092 0.117789 Se\n0.907696 0.099637 0.617789 Se\n0.981848 0.289908 0.882211 Se\n0.394272 0.304514 0.790096 Se\n0.793534 0.337990 0.422750 Se\n0.206466 0.662010 0.577250 Se\n0.584760 0.629216 0.922750 Se\n0.665245 0.973459 0.082931 Se\n0.390529 0.582313 0.417069 Se\n0.334755 0.026541 0.917069 Se\n0.415240 0.370784 0.077250 Se\n0.605728 0.695486 0.209904 Se\n0.092304 0.900363 0.382211 Se\n0.985582 0.395824 0.290096 Se\n",
            "nsites": 36,
            "nelements": 3,
            "elements": [
                "Tl",
                "Si",
                "Se"
            ],
            "chemical_system": "Se-Si-Tl",
            "density": 7.124954675154874,
            "density_atomic": 0.03324847623037098,
            "volume": 1082.756387106716,
            "volume_molar": 18.112531588738037,
            "formula_full": "Tl16 Si4 Se16",
            "formula_reduced": "Tl4SiSe4",
            "formula_anonymous": "AB4C4",
            "energy_above_hull": 0.7544847185185184,
            "spacegroup": 15
        },
        {
            "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-98092",
            "created_at": "2022-09-04T14:35:53.694121Z",
            "updated_at": "2022-09-04T14:35:53.694149Z",
            "structure_string": "Tl12 Si4 Te12\n1.0\n9.490796 0.022732 1.092695\n1.833202 9.612872 0.154233\n-0.002627 0.011014 10.592237\nTl Si Te\n12 4 12\ndirect\n0.098169 0.962092 0.646418 Tl\n0.486607 0.618674 0.645443 Tl\n0.196220 0.150570 0.158030 Tl\n0.641738 0.220535 0.916234 Tl\n0.803780 0.849430 0.841970 Tl\n0.683360 0.712386 0.239001 Tl\n0.098132 0.568549 0.344504 Tl\n0.358262 0.779465 0.083766 Tl\n0.316640 0.287613 0.760999 Tl\n0.901868 0.431450 0.655496 Tl\n0.513394 0.381325 0.354558 Tl\n0.901831 0.037907 0.353583 Tl\n0.574861 0.982049 0.582260 Si\n0.425139 0.017950 0.417740 Si\n0.087786 0.570804 0.985199 Si\n0.912214 0.429195 0.014802 Si\n0.311877 0.442685 0.077306 Te\n0.318756 0.798070 0.406388 Te\n0.127351 0.619549 0.748180 Te\n0.221633 0.225939 0.472997 Te\n0.002850 0.201733 0.894829 Te\n0.778367 0.774060 0.527004 Te\n0.681244 0.201929 0.593613 Te\n0.580309 0.067418 0.216730 Te\n0.688123 0.557315 0.922694 Te\n0.872649 0.380450 0.251820 Te\n0.419691 0.932582 0.783270 Te\n0.997150 0.798266 0.105171 Te\n",
            "nsites": 28,
            "nelements": 3,
            "elements": [
                "Tl",
                "Si",
                "Te"
            ],
            "chemical_system": "Si-Te-Tl",
            "density": 7.041479412923173,
            "density_atomic": 0.028986640636196548,
            "volume": 965.9622289943976,
            "volume_molar": 20.77557325659863,
            "formula_full": "Tl12 Si4 Te12",
            "formula_reduced": "Tl3SiTe3",
            "formula_anonymous": "AB3C3",
            "energy_above_hull": 0.6044370999999997,
            "spacegroup": 2
        },
        {
            "id": "jvasp-98218",
            "created_at": "2022-09-04T14:36:04.159004Z",
            "updated_at": "2022-09-04T14:36:04.159022Z",
            "structure_string": "Tl12 Si4 O14\n1.0\n9.698968 0.000002 0.000000\n-4.849486 8.399551 0.000000\n-0.000000 0.000000 8.022496\nTl Si O\n12 4 14\ndirect\n0.354237 0.304942 0.120764 Tl\n0.950705 0.645763 0.120764 Tl\n0.645763 0.695057 0.879236 Tl\n0.304942 0.950705 0.879236 Tl\n0.049295 0.354237 0.879236 Tl\n0.347875 0.313199 0.630688 Tl\n0.686801 0.034676 0.630688 Tl\n0.965324 0.652125 0.630688 Tl\n0.652125 0.686801 0.369313 Tl\n0.313198 0.965324 0.369313 Tl\n0.034676 0.347875 0.369313 Tl\n0.695058 0.049295 0.120764 Tl\n0.666667 0.333333 0.832996 Si\n0.333333 0.666666 0.583226 Si\n0.666667 0.333333 0.416775 Si\n0.333333 0.666666 0.167005 Si\n0.147380 0.549628 0.112054 O\n0.148125 0.546242 0.638865 O\n0.453757 0.601882 0.638865 O\n0.398117 0.851875 0.638865 O\n0.851875 0.453757 0.361135 O\n0.546242 0.398117 0.361135 O\n0.601882 0.148125 0.361135 O\n0.333333 0.666666 0.375308 O\n0.666667 0.333333 0.624692 O\n0.402247 0.852619 0.112054 O\n0.597752 0.147380 0.887946 O\n0.549628 0.402247 0.887946 O\n0.450372 0.597752 0.112054 O\n0.852620 0.450372 0.887946 O\n",
            "nsites": 30,
            "nelements": 3,
            "elements": [
                "Tl",
                "Si",
                "O"
            ],
            "chemical_system": "O-Si-Tl",
            "density": 7.085916836596363,
            "density_atomic": 0.04590184012121611,
            "volume": 653.5685698171785,
            "volume_molar": 13.11960641250312,
            "formula_full": "Tl12 Si4 O14",
            "formula_reduced": "Tl6Si2O7",
            "formula_anonymous": "A2B6C7",
            "energy_above_hull": 1.4855224866666663,
            "spacegroup": 147
        },
        {
            "id": "jvasp-58879",
            "created_at": "2022-09-04T14:37:02.133557Z",
            "updated_at": "2022-09-04T14:37:02.133583Z",
            "structure_string": "Tl12 Se2 I8\n1.0\n9.245408 0.000000 0.000000\n0.000000 9.245408 0.000000\n0.000000 0.000000 9.764742\nTl Se I\n12 2 8\ndirect\n0.683375 0.889243 0.500000 Tl\n0.500000 0.500000 0.306069 Tl\n0.500000 0.500000 0.693931 Tl\n0.000000 -0.000000 0.806068 Tl\n0.389243 0.183375 0.000000 Tl\n0.816625 0.389243 0.000000 Tl\n0.000000 -0.000000 0.193931 Tl\n0.889243 0.316625 0.500000 Tl\n0.110757 0.683375 0.500000 Tl\n0.610757 0.816625 0.000000 Tl\n0.316625 0.110757 0.500000 Tl\n0.183375 0.610757 0.000000 Tl\n0.000000 -0.000000 0.500000 Se\n0.500000 0.500000 0.000000 Se\n0.662902 0.162902 0.250000 I\n0.162902 0.337098 0.750000 I\n0.662902 0.162902 0.750000 I\n0.337098 0.837098 0.750000 I\n0.837098 0.662902 0.750000 I\n0.837098 0.662902 0.250000 I\n0.337098 0.837098 0.250000 I\n0.162902 0.337098 0.250000 I\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Tl",
                "Se",
                "I"
            ],
            "chemical_system": "I-Se-Tl",
            "density": 7.213311038873596,
            "density_atomic": 0.02635783561549914,
            "volume": 834.6664089164965,
            "volume_molar": 22.847630009722096,
            "formula_full": "Tl12 Se2 I8",
            "formula_reduced": "Tl6SeI4",
            "formula_anonymous": "AB4C6",
            "energy_above_hull": 0.0,
            "spacegroup": 128
        },
        {
            "id": "jvasp-13395",
            "created_at": "2022-09-04T14:37:08.916167Z",
            "updated_at": "2022-09-04T14:37:08.916192Z",
            "structure_string": "Tl12 Se2 I8\n1.0\n9.245491 0.000000 -0.000000\n0.000000 9.245491 0.000000\n-0.000000 0.000000 9.764169\nTl Se I\n12 2 8\ndirect\n0.683364 0.889249 0.500000 Tl\n0.500000 0.500000 0.306079 Tl\n0.500000 0.500000 0.693921 Tl\n0.000000 0.000000 0.806079 Tl\n0.389249 0.183364 0.000000 Tl\n0.816636 0.389249 0.000000 Tl\n0.000000 0.000000 0.193921 Tl\n0.889249 0.316636 0.500000 Tl\n0.110751 0.683364 0.500000 Tl\n0.610751 0.816636 0.000000 Tl\n0.316636 0.110751 0.500000 Tl\n0.183364 0.610751 0.000000 Tl\n0.000000 0.000000 0.500000 Se\n0.500000 0.500000 0.000000 Se\n0.662910 0.162910 0.250000 I\n0.162910 0.337090 0.750000 I\n0.662910 0.162910 0.750000 I\n0.337090 0.837090 0.750000 I\n0.837090 0.662910 0.750000 I\n0.837090 0.662910 0.250000 I\n0.337090 0.837090 0.250000 I\n0.162910 0.337090 0.250000 I\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Tl",
                "Se",
                "I"
            ],
            "chemical_system": "I-Se-Tl",
            "density": 7.2136048246127595,
            "density_atomic": 0.02635890912476241,
            "volume": 834.6324157752223,
            "volume_molar": 22.846699502987423,
            "formula_full": "Tl12 Se2 I8",
            "formula_reduced": "Tl6SeI4",
            "formula_anonymous": "AB4C6",
            "energy_above_hull": 0.0,
            "spacegroup": 128
        },
        {
            "id": "jvasp-21252",
            "created_at": "2022-09-04T14:38:36.248528Z",
            "updated_at": "2022-09-04T14:38:36.248556Z",
            "structure_string": "Tl12 Sb4 Se12\n1.0\n9.549086 -0.000000 -0.000000\n-0.000000 9.549086 -0.000000\n-0.000000 -0.000000 9.549086\nTl Sb Se\n12 4 12\ndirect\n0.692663 0.807338 0.192662 Tl\n0.807338 0.192662 0.692663 Tl\n0.192662 0.692663 0.807338 Tl\n0.307338 0.307338 0.307338 Tl\n0.447613 0.052388 0.947613 Tl\n0.052388 0.947613 0.447613 Tl\n0.947613 0.447613 0.052388 Tl\n0.552388 0.552388 0.552388 Tl\n0.910615 0.589386 0.410615 Tl\n0.589386 0.410615 0.910615 Tl\n0.410615 0.910615 0.589386 Tl\n0.089385 0.089385 0.089385 Tl\n0.198443 0.301558 0.698443 Sb\n0.301558 0.698443 0.198443 Sb\n0.698443 0.198443 0.301558 Sb\n0.801558 0.801558 0.801558 Sb\n0.893689 0.549589 0.738105 Se\n0.393689 0.950412 0.261895 Se\n0.106311 0.049589 0.761896 Se\n0.950412 0.261895 0.393689 Se\n0.761896 0.106311 0.049589 Se\n0.261895 0.393689 0.950412 Se\n0.549589 0.738105 0.893689 Se\n0.738105 0.893689 0.549589 Se\n0.049589 0.761896 0.106311 Se\n0.450411 0.238105 0.606311 Se\n0.238105 0.606311 0.450411 Se\n0.606311 0.450411 0.238105 Se\n",
            "nsites": 28,
            "nelements": 3,
            "elements": [
                "Tl",
                "Sb",
                "Se"
            ],
            "chemical_system": "Sb-Se-Tl",
            "density": 7.413035089722017,
            "density_atomic": 0.03215678466012752,
            "volume": 870.733821678332,
            "volume_molar": 18.727434423713053,
            "formula_full": "Tl12 Sb4 Se12",
            "formula_reduced": "Tl3SbSe3",
            "formula_anonymous": "AB3C3",
            "energy_above_hull": 0.5750891428571427,
            "spacegroup": 198
        },
        {
            "id": "jvasp-97693",
            "created_at": "2022-09-04T14:36:18.558991Z",
            "updated_at": "2022-09-04T14:36:18.559014Z",
            "structure_string": "Tl12 S2 I8\n1.0\n9.249408 0.000000 0.000000\n0.000000 9.249408 0.000000\n0.000000 0.000000 9.708252\nTl S I\n12 2 8\ndirect\n0.690813 0.890943 0.500000 Tl\n0.500000 0.500000 0.700221 Tl\n0.000000 0.000000 0.799779 Tl\n0.390943 0.190813 0.000000 Tl\n0.809187 0.390943 0.000000 Tl\n0.190813 0.609057 0.000000 Tl\n0.890943 0.309187 0.500000 Tl\n0.109057 0.690813 0.500000 Tl\n0.609057 0.809187 0.000000 Tl\n0.309187 0.109057 0.500000 Tl\n0.500000 0.500000 0.299779 Tl\n0.000000 0.000000 0.200221 Tl\n0.500000 0.500000 0.000000 S\n0.000000 0.000000 0.500000 S\n0.161768 0.338232 0.250000 I\n0.661768 0.161768 0.250000 I\n0.338232 0.838232 0.250000 I\n0.838232 0.661768 0.250000 I\n0.838232 0.661768 0.750000 I\n0.338232 0.838232 0.750000 I\n0.661768 0.161768 0.750000 I\n0.161768 0.338232 0.750000 I\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Tl",
                "S",
                "I"
            ],
            "chemical_system": "I-S-Tl",
            "density": 7.061494384622231,
            "density_atomic": 0.026488280446965957,
            "volume": 830.555990376489,
            "volume_molar": 22.73511401412919,
            "formula_full": "Tl12 S2 I8",
            "formula_reduced": "Tl6SI4",
            "formula_anonymous": "AB4C6",
            "energy_above_hull": 0.0,
            "spacegroup": 128
        },
        {
            "id": "jvasp-13396",
            "created_at": "2022-09-04T14:37:09.058972Z",
            "updated_at": "2022-09-04T14:37:09.058991Z",
            "structure_string": "Tl12 S2 Br8\n1.0\n8.756490 0.000000 0.000000\n0.000000 8.756490 -0.000000\n0.000000 0.000000 9.393206\nTl S Br\n12 2 8\ndirect\n0.679711 0.886137 0.500000 Tl\n0.500000 0.500000 0.304835 Tl\n0.500000 0.500000 0.695165 Tl\n0.000000 0.000000 0.804835 Tl\n0.386137 0.179711 0.000000 Tl\n0.820289 0.386137 0.000000 Tl\n0.000000 0.000000 0.195165 Tl\n0.886137 0.320289 0.500000 Tl\n0.113863 0.679711 0.500000 Tl\n0.613863 0.820289 0.000000 Tl\n0.320289 0.113863 0.500000 Tl\n0.179711 0.613863 0.000000 Tl\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 0.000000 S\n0.663230 0.163230 0.250000 Br\n0.163230 0.336770 0.750000 Br\n0.663230 0.163230 0.750000 Br\n0.336770 0.836770 0.750000 Br\n0.836770 0.663230 0.750000 Br\n0.836770 0.663230 0.250000 Br\n0.336770 0.836770 0.250000 Br\n0.163230 0.336770 0.250000 Br\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Tl",
                "S",
                "Br"
            ],
            "chemical_system": "Br-S-Tl",
            "density": 7.276237209206721,
            "density_atomic": 0.030545604332669136,
            "volume": 720.2345633892259,
            "volume_molar": 19.715245095213916,
            "formula_full": "Tl12 S2 Br8",
            "formula_reduced": "Tl6SBr4",
            "formula_anonymous": "AB4C6",
            "energy_above_hull": 4.8572257327350605e-17,
            "spacegroup": 128
        },
        {
            "id": "jvasp-58880",
            "created_at": "2022-09-04T14:36:58.317935Z",
            "updated_at": "2022-09-04T14:36:58.317959Z",
            "structure_string": "Tl12 S2 Br8\n1.0\n8.756514 0.000000 0.000000\n0.000000 8.756514 0.000000\n0.000000 0.000000 9.393152\nTl S Br\n12 2 8\ndirect\n0.679708 0.886143 0.500000 Tl\n0.500000 0.500000 0.304836 Tl\n0.500000 0.500000 0.695164 Tl\n0.000000 0.000000 0.804836 Tl\n0.386143 0.179708 0.000000 Tl\n0.820291 0.386143 0.000000 Tl\n0.000000 0.000000 0.195164 Tl\n0.886143 0.320291 0.500000 Tl\n0.113857 0.679708 0.500000 Tl\n0.613857 0.820291 0.000000 Tl\n0.320291 0.113857 0.500000 Tl\n0.179708 0.613857 0.000000 Tl\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 0.000000 S\n0.663234 0.163234 0.250000 Br\n0.163234 0.336766 0.750000 Br\n0.663234 0.163234 0.750000 Br\n0.336766 0.836766 0.750000 Br\n0.836766 0.663234 0.750000 Br\n0.836766 0.663234 0.250000 Br\n0.336766 0.836766 0.250000 Br\n0.163234 0.336766 0.250000 Br\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Tl",
                "S",
                "Br"
            ],
            "chemical_system": "Br-S-Tl",
            "density": 7.276239153501109,
            "density_atomic": 0.03054561249480642,
            "volume": 720.2343709343066,
            "volume_molar": 19.715239827074758,
            "formula_full": "Tl12 S2 Br8",
            "formula_reduced": "Tl6SBr4",
            "formula_anonymous": "AB4C6",
            "energy_above_hull": 0.0,
            "spacegroup": 128
        },
        {
            "id": "jvasp-22796",
            "created_at": "2022-09-04T14:37:47.861525Z",
            "updated_at": "2022-09-04T14:37:47.861545Z",
            "structure_string": "Tl12 P4 S16\n1.0\n8.865865 -0.000000 0.000000\n0.000000 9.083428 0.000000\n0.000000 0.000000 10.867916\nTl P S\n12 4 16\ndirect\n0.381179 0.607789 0.750000 Tl\n0.881179 0.892211 0.750000 Tl\n0.118820 0.107789 0.250000 Tl\n0.618820 0.392211 0.250000 Tl\n0.441674 0.802946 0.451561 Tl\n0.941674 0.697054 0.048439 Tl\n0.058325 0.302946 0.548439 Tl\n0.558325 0.197054 0.951562 Tl\n0.558325 0.197054 0.548439 Tl\n0.058325 0.302946 0.951562 Tl\n0.941674 0.697054 0.451561 Tl\n0.441674 0.802946 0.048439 Tl\n0.222766 0.526352 0.250000 P\n0.722765 0.973649 0.250000 P\n0.277234 0.026352 0.750000 P\n0.777234 0.473648 0.750000 P\n0.660678 0.534657 0.594121 S\n0.160678 0.965343 0.905880 S\n0.160678 0.965343 0.594121 S\n0.660678 0.534657 0.905880 S\n0.339321 0.465343 0.405879 S\n0.839321 0.034657 0.094121 S\n0.509299 0.064300 0.250000 S\n0.009299 0.435700 0.250000 S\n0.490700 0.935700 0.750000 S\n0.698709 0.745319 0.250000 S\n0.198709 0.754682 0.250000 S\n0.801290 0.245319 0.750000 S\n0.301291 0.254681 0.750000 S\n0.339321 0.465343 0.094121 S\n0.990700 0.564300 0.750000 S\n0.839321 0.034657 0.405879 S\n",
            "nsites": 32,
            "nelements": 3,
            "elements": [
                "Tl",
                "P",
                "S"
            ],
            "chemical_system": "P-S-Tl",
            "density": 5.861719094721927,
            "density_atomic": 0.03656224152104779,
            "volume": 875.2198625890745,
            "volume_molar": 16.470928776435205,
            "formula_full": "Tl12 P4 S16",
            "formula_reduced": "Tl3PS4",
            "formula_anonymous": "AB3C4",
            "energy_above_hull": 1.1974704125,
            "spacegroup": 62
        },
        {
            "id": "jvasp-21078",
            "created_at": "2022-09-04T14:37:30.086302Z",
            "updated_at": "2022-09-04T14:37:30.086322Z",
            "structure_string": "Tl12 As4 S16\n1.0\n8.990685 0.000000 0.000000\n0.000000 9.194054 0.000000\n0.000000 0.000000 10.899195\nTl As S\n12 4 16\ndirect\n0.935345 0.194789 0.450374 Tl\n0.435346 0.305211 0.049626 Tl\n0.564654 0.694788 0.549626 Tl\n0.064654 0.805211 0.950374 Tl\n0.064654 0.805211 0.549626 Tl\n0.564654 0.694788 0.950374 Tl\n0.435346 0.305211 0.450374 Tl\n0.935345 0.194789 0.049626 Tl\n0.385506 0.106381 0.750000 Tl\n0.885505 0.393619 0.750000 Tl\n0.114494 0.606381 0.250000 Tl\n0.614494 0.893618 0.250000 Tl\n0.780083 0.974826 0.750000 As\n0.719916 0.474826 0.250000 As\n0.280084 0.525174 0.750000 As\n0.219916 0.025174 0.250000 As\n0.191189 0.265395 0.250000 S\n0.691189 0.234605 0.250000 S\n0.845596 0.535201 0.084479 S\n0.345596 0.964798 0.415521 S\n0.654404 0.035201 0.915521 S\n0.154404 0.464798 0.584479 S\n0.154404 0.464798 0.915521 S\n0.654404 0.035201 0.584479 S\n0.845596 0.535201 0.415521 S\n0.004169 0.072478 0.750000 S\n0.495831 0.572478 0.250000 S\n0.504169 0.427521 0.750000 S\n0.995831 0.927521 0.250000 S\n0.808810 0.734605 0.750000 S\n0.345596 0.964798 0.084479 S\n0.308810 0.765395 0.750000 S\n",
            "nsites": 32,
            "nelements": 3,
            "elements": [
                "Tl",
                "As",
                "S"
            ],
            "chemical_system": "As-S-Tl",
            "density": 6.018404715283631,
            "density_atomic": 0.035518590532018716,
            "volume": 900.9366509392643,
            "volume_molar": 16.95489789937261,
            "formula_full": "Tl12 As4 S16",
            "formula_reduced": "Tl3AsS4",
            "formula_anonymous": "AB3C4",
            "energy_above_hull": 1.11823244375,
            "spacegroup": 62
        }
    ]
}