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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=1284",
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"results": [
{
"id": "jvasp-9093",
"created_at": "2022-09-04T14:37:19.531348Z",
"updated_at": "2022-09-04T14:37:19.531381Z",
"structure_string": "Rb8 Te4\n1.0\n5.552510 -0.000000 0.000000\n-0.000000 8.888148 0.000000\n0.000000 0.000000 10.977699\nRb Te\n8 4\ndirect\n0.750000 0.969080 0.179327 Rb\n0.250000 0.030921 0.820673 Rb\n0.750000 0.469080 0.320673 Rb\n0.250000 0.530921 0.679327 Rb\n0.750000 0.847252 0.570974 Rb\n0.250000 0.152748 0.429026 Rb\n0.750000 0.347252 0.929026 Rb\n0.250000 0.652749 0.070974 Rb\n0.750000 0.753451 0.884839 Te\n0.250000 0.246549 0.115161 Te\n0.750000 0.253451 0.615161 Te\n0.250000 0.746549 0.384839 Te\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Rb",
"Te"
],
"chemical_system": "Rb-Te",
"density": 3.66010269393922,
"density_atomic": 0.022149774057004565,
"volume": 541.7662486812213,
"volume_molar": 27.188271738128993,
"formula_full": "Rb8 Te4",
"formula_reduced": "Rb2Te",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-97782",
"created_at": "2022-09-04T14:35:52.801674Z",
"updated_at": "2022-09-04T14:35:52.801706Z",
"structure_string": "Rb8 Tc12 S26\n1.0\n9.658463 -0.070566 -0.824221\n-4.874681 8.338367 -0.824221\n0.018340 0.031697 14.011694\nRb Tc S\n8 12 26\ndirect\n0.696169 0.754413 0.336927 Rb\n0.626934 0.902069 0.617215 Rb\n0.097932 0.373067 0.882785 Rb\n0.373066 0.097932 0.382785 Rb\n0.902068 0.626933 0.117215 Rb\n0.754413 0.696169 0.836927 Rb\n0.303832 0.245587 0.663073 Rb\n0.245587 0.303832 0.163073 Rb\n0.317313 0.014509 0.978451 Tc\n0.398950 0.842466 0.075547 Tc\n0.682688 0.985491 0.021549 Tc\n0.014509 0.317313 0.478451 Tc\n0.426041 0.844788 0.891269 Tc\n0.155213 0.573959 0.608731 Tc\n0.573959 0.155212 0.108731 Tc\n0.844787 0.426041 0.391269 Tc\n0.842466 0.398950 0.575547 Tc\n0.601050 0.157534 0.924453 Tc\n0.985491 0.682688 0.521549 Tc\n0.157535 0.601050 0.424453 Tc\n0.303129 0.004093 0.148058 S\n0.503019 0.694974 0.991417 S\n0.305027 0.496982 0.508583 S\n0.639462 0.360538 0.250000 S\n0.004094 0.303129 0.648058 S\n0.360538 0.639462 0.750000 S\n0.254332 0.639179 0.177595 S\n0.360821 0.745668 0.322405 S\n0.745668 0.360821 0.822405 S\n0.639179 0.254332 0.677595 S\n0.923385 0.955951 0.054314 S\n0.044049 0.076615 0.445686 S\n0.076615 0.044049 0.945686 S\n0.955951 0.923385 0.554314 S\n0.645267 0.984722 0.188763 S\n0.015278 0.354734 0.311237 S\n0.354733 0.015278 0.811237 S\n0.984722 0.645267 0.688763 S\n0.833922 0.274884 0.050160 S\n0.725115 0.166077 0.449840 S\n0.166078 0.725116 0.949840 S\n0.274885 0.833923 0.550160 S\n0.496981 0.305027 0.008583 S\n0.694973 0.503018 0.491417 S\n0.696871 0.995907 0.851942 S\n0.995907 0.696871 0.351942 S\n",
"nsites": 46,
"nelements": 3,
"elements": [
"Rb",
"Tc",
"S"
],
"chemical_system": "Rb-S-Tc",
"density": 3.978676344812462,
"density_atomic": 0.04092053150397464,
"volume": 1124.1300713685007,
"volume_molar": 14.71667287463034,
"formula_full": "Rb8 Tc12 S26",
"formula_reduced": "Rb4Tc6S13",
"formula_anonymous": "A4B6C13",
"energy_above_hull": 2.928874739130435,
"spacegroup": 15
},
{
"id": "jvasp-91407",
"created_at": "2022-09-04T14:35:56.841580Z",
"updated_at": "2022-09-04T14:35:56.841604Z",
"structure_string": "Rb8 Sn8 S32\n1.0\n9.397287 0.000000 -2.878212\n0.000000 10.138545 0.000000\n-0.117193 0.000000 14.308868\nRb Sn S\n8 8 32\ndirect\n0.532076 0.225278 0.912535 Rb\n0.967925 0.725278 0.587465 Rb\n0.467925 0.774721 0.087465 Rb\n0.032075 0.274722 0.412535 Rb\n0.851034 0.132946 0.704769 Rb\n0.648967 0.632946 0.795231 Rb\n0.148966 0.867053 0.295231 Rb\n0.351034 0.367054 0.204769 Rb\n0.025679 0.173810 0.015007 Sn\n0.406695 -0.000004 0.596938 Sn\n0.906695 0.500003 0.096938 Sn\n0.593305 0.000004 0.403063 Sn\n0.525679 0.326189 0.515007 Sn\n0.974322 0.826189 0.984993 Sn\n0.474321 0.673810 0.484993 Sn\n0.093305 0.499996 0.903063 Sn\n0.490131 0.769013 0.332487 S\n0.990131 0.730986 0.832487 S\n0.509870 0.230987 0.667514 S\n0.687360 0.142712 0.190214 S\n0.812640 0.642711 0.309786 S\n0.312640 0.857288 0.809786 S\n0.306082 0.657220 0.769596 S\n0.693918 0.342780 0.230405 S\n0.806082 0.842779 0.269596 S\n0.193918 0.157220 0.730405 S\n0.646341 0.446246 0.100978 S\n0.853660 0.946245 0.399023 S\n0.009869 0.269013 0.167514 S\n0.187360 0.357288 0.690214 S\n0.007836 0.432851 0.715600 S\n0.329482 0.462878 0.419068 S\n0.992164 0.567149 0.284401 S\n0.507836 0.067149 0.215600 S\n0.140563 0.602483 0.076683 S\n0.359437 0.102483 0.423317 S\n0.859437 0.397516 0.923317 S\n0.640564 0.897516 0.576683 S\n0.353660 0.553754 0.899023 S\n0.170518 0.962878 0.080933 S\n0.670518 0.537121 0.580933 S\n0.829483 0.037121 0.919068 S\n0.714346 0.225868 0.460664 S\n0.785654 0.725868 0.039337 S\n0.285654 0.774132 0.539337 S\n0.214346 0.274132 0.960664 S\n0.492164 0.932851 0.784401 S\n0.146341 0.053754 0.600978 S\n",
"nsites": 48,
"nelements": 3,
"elements": [
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"Sn",
"S"
],
"chemical_system": "Rb-S-Sn",
"density": 3.2475577730177587,
"density_atomic": 0.035297881363858696,
"volume": 1359.8549869099772,
"volume_molar": 17.06091280074967,
"formula_full": "Rb8 Sn8 S32",
"formula_reduced": "RbSnS4",
"formula_anonymous": "ABC4",
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"spacegroup": 14
},
{
"id": "jvasp-10084",
"created_at": "2022-09-04T14:38:02.633026Z",
"updated_at": "2022-09-04T14:38:02.633052Z",
"structure_string": "Rb8 Sn2 O8\n1.0\n6.795586 0.005210 0.057453\n2.713946 6.258800 0.018033\n1.904665 2.674371 9.628678\nRb Sn O\n8 2 8\ndirect\n0.741868 0.591603 0.164130 Rb\n0.258134 0.408397 0.835870 Rb\n0.764714 0.239397 0.967196 Rb\n0.235288 0.760603 0.032804 Rb\n0.278798 0.508041 0.440947 Rb\n0.721204 0.491959 0.559052 Rb\n0.789768 0.030109 0.376942 Rb\n0.210234 0.969891 0.623058 Rb\n0.277185 0.156066 0.247622 Sn\n0.722817 0.843934 0.752377 Sn\n0.871200 0.839677 0.904768 O\n0.128801 0.160323 0.095232 O\n0.036158 0.303208 0.374252 O\n0.963844 0.696792 0.625748 O\n0.466589 0.336383 0.188675 O\n0.533413 0.663617 0.811325 O\n0.454166 0.850742 0.353149 O\n0.545836 0.149258 0.646851 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"O"
],
"chemical_system": "O-Rb-Sn",
"density": 4.261688513974637,
"density_atomic": 0.04403159125715647,
"volume": 408.7973994597448,
"volume_molar": 13.676863788158505,
"formula_full": "Rb8 Sn2 O8",
"formula_reduced": "Rb4SnO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 0.6466306333333331,
"spacegroup": 2
},
{
"id": "jvasp-50514",
"created_at": "2022-09-04T14:37:06.207946Z",
"updated_at": "2022-09-04T14:37:06.207963Z",
"structure_string": "Rb8 Sn2 O6\n1.0\n3.327176 9.650835 -0.147444\n-3.327176 9.650835 0.147444\n-2.598005 0.000000 6.475796\nRb Sn O\n8 2 6\ndirect\n0.597698 0.721870 0.808945 Rb\n0.457609 0.486858 0.721543 Rb\n0.037016 0.062904 0.741994 Rb\n0.347855 0.233119 0.880270 Rb\n0.278131 0.402302 0.308944 Rb\n0.513142 0.542391 0.221543 Rb\n0.937096 0.962985 0.241994 Rb\n0.766882 0.652145 0.380270 Rb\n0.875244 0.846894 0.722052 Sn\n0.153106 0.124756 0.222052 Sn\n0.165463 0.684899 0.947042 O\n0.033681 0.647635 0.542416 O\n0.315101 0.834537 0.447042 O\n0.352366 0.966319 0.042415 O\n0.708776 0.150796 0.528426 O\n0.849205 0.291224 0.028426 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"O"
],
"chemical_system": "O-Rb-Sn",
"density": 4.134896629707812,
"density_atomic": 0.0391693875776412,
"volume": 408.4822610076542,
"volume_molar": 15.374610460944707,
"formula_full": "Rb8 Sn2 O6",
"formula_reduced": "Rb4SnO3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.385944025,
"spacegroup": 9
},
{
"id": "jvasp-87210",
"created_at": "2022-09-04T14:38:14.649034Z",
"updated_at": "2022-09-04T14:38:14.649063Z",
"structure_string": "Rb8 Se4 O16\n1.0\n6.148392 -0.000000 0.000000\n0.000000 7.992986 0.000000\n0.000000 0.000000 10.806558\nRb Se O\n8 4 16\ndirect\n0.750000 0.667347 0.589129 Rb\n0.750000 0.167347 0.910871 Rb\n0.250000 0.832653 0.089129 Rb\n0.750000 0.989047 0.296800 Rb\n0.250000 0.010953 0.703201 Rb\n0.750000 0.489047 0.203201 Rb\n0.250000 0.510953 0.796800 Rb\n0.250000 0.332653 0.410871 Rb\n0.750000 0.229603 0.579218 Se\n0.250000 0.770398 0.420782 Se\n0.750000 0.729603 0.920783 Se\n0.250000 0.270397 0.079218 Se\n0.250000 0.479288 0.082597 O\n0.750000 0.520712 0.917403 O\n0.972403 0.803044 0.849396 O\n0.750000 0.301798 0.433195 O\n0.250000 0.698202 0.566805 O\n0.750000 0.801798 0.066805 O\n0.250000 0.198202 0.933195 O\n0.972403 0.303044 0.650604 O\n0.472404 0.696957 0.349396 O\n0.527596 0.803044 0.849396 O\n0.027596 0.196956 0.150604 O\n0.027596 0.696957 0.349396 O\n0.527596 0.303044 0.650604 O\n0.472404 0.196956 0.150604 O\n0.750000 0.020712 0.582597 O\n0.250000 0.979289 0.417403 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
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"Se",
"O"
],
"chemical_system": "O-Rb-Se",
"density": 3.925843713381721,
"density_atomic": 0.05272299118407532,
"volume": 531.0776071532383,
"volume_molar": 11.422228945574227,
"formula_full": "Rb8 Se4 O16",
"formula_reduced": "Rb2SeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2771867666666663,
"spacegroup": 62
},
{
"id": "jvasp-54563",
"created_at": "2022-09-04T14:38:36.413234Z",
"updated_at": "2022-09-04T14:38:36.413259Z",
"structure_string": "Rb8 Se20\n1.0\n6.804190 0.000000 0.000000\n0.000000 7.170978 0.000000\n0.000000 0.000000 18.156440\nRb Se\n8 20\ndirect\n0.587414 0.241909 0.160488 Rb\n0.615187 0.414584 0.509450 Rb\n0.912586 0.758091 0.660488 Rb\n0.884813 0.585416 0.009450 Rb\n0.115187 0.085416 0.490550 Rb\n0.384813 0.914585 0.990550 Rb\n0.412586 0.741909 0.339512 Rb\n0.087414 0.258091 0.839512 Rb\n0.079964 0.756426 0.836775 Se\n0.752818 0.135675 0.348050 Se\n0.923430 0.639093 0.374690 Se\n0.420036 0.243575 0.336775 Se\n0.468333 0.128732 0.704801 Se\n0.747182 0.864326 0.848050 Se\n0.601118 0.920237 0.515395 Se\n0.920036 0.256426 0.663225 Se\n0.101118 0.579764 0.484605 Se\n0.076570 0.139093 0.125310 Se\n0.531667 0.628732 0.795199 Se\n0.579964 0.743575 0.163225 Se\n0.247182 0.635675 0.151950 Se\n0.252818 0.364326 0.651950 Se\n0.968333 0.371269 0.295199 Se\n0.031667 0.871269 0.204801 Se\n0.423430 0.860907 0.625310 Se\n0.898882 0.079764 0.015395 Se\n0.576570 0.360907 0.874690 Se\n0.398882 0.420236 0.984605 Se\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Rb",
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],
"chemical_system": "Rb-Se",
"density": 4.2416719372791745,
"density_atomic": 0.031606216456954744,
"volume": 885.9016718478109,
"volume_molar": 19.05365916923874,
"formula_full": "Rb8 Se20",
"formula_reduced": "Rb2Se5",
"formula_anonymous": "A2B5",
"energy_above_hull": 0.9639304952380952,
"spacegroup": 19
},
{
"id": "jvasp-10124",
"created_at": "2022-09-04T14:38:31.679891Z",
"updated_at": "2022-09-04T14:38:31.679913Z",
"structure_string": "Rb8 Sb8\n1.0\n7.252008 0.000000 0.000000\n0.000000 7.302287 0.000000\n0.000000 0.000000 12.837755\nRb Sb\n8 8\ndirect\n0.325418 0.341011 0.713703 Rb\n0.825418 0.158989 0.286297 Rb\n0.674582 0.841011 0.786297 Rb\n0.174582 0.658989 0.213703 Rb\n0.591189 0.599556 0.418366 Rb\n0.091189 0.900444 0.581634 Rb\n0.408811 0.099556 0.081634 Rb\n0.908811 0.400444 0.918365 Rb\n0.089861 0.448940 0.465810 Sb\n0.589861 0.051060 0.534190 Sb\n0.910139 0.948940 0.034190 Sb\n0.410139 0.551061 0.965810 Sb\n0.823857 0.333025 0.623309 Sb\n0.323857 0.166975 0.376691 Sb\n0.176143 0.833025 0.876691 Sb\n0.676143 0.666975 0.123309 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Rb",
"Sb"
],
"chemical_system": "Rb-Sb",
"density": 4.049308314469349,
"density_atomic": 0.02353497422527274,
"volume": 679.8392828838792,
"volume_molar": 25.588049098151117,
"formula_full": "Rb8 Sb8",
"formula_reduced": "RbSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.2487787000000001,
"spacegroup": 19
},
{
"id": "jvasp-10683",
"created_at": "2022-09-04T14:37:11.623275Z",
"updated_at": "2022-09-04T14:37:11.623311Z",
"structure_string": "Rb8 Sb8\n1.0\n0.000000 7.391770 0.021817\n7.200816 0.000000 0.000000\n0.000000 -5.674561 -12.640012\nRb Sb\n8 8\ndirect\n0.740423 0.829861 0.530825 Rb\n0.259577 0.329861 0.969175 Rb\n0.259577 0.170140 0.469175 Rb\n0.740423 0.670140 0.030825 Rb\n0.283044 0.596597 0.667077 Rb\n0.716955 0.096597 0.832923 Rb\n0.716955 0.403404 0.332923 Rb\n0.283044 0.903404 0.167077 Rb\n0.175457 0.829108 0.874091 Sb\n0.824543 0.329108 0.625908 Sb\n0.824543 0.170892 0.125909 Sb\n0.175457 0.670892 0.374091 Sb\n0.174262 0.096021 0.714731 Sb\n0.825738 0.596021 0.785268 Sb\n0.825738 0.903980 0.285269 Sb\n0.174262 0.403979 0.214731 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Rb",
"Sb"
],
"chemical_system": "Rb-Sb",
"density": 4.097182397218412,
"density_atomic": 0.023813223055951228,
"volume": 671.8956086879384,
"volume_molar": 25.289062072154028,
"formula_full": "Rb8 Sb8",
"formula_reduced": "RbSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.2467987000000001,
"spacegroup": 14
},
{
"id": "jvasp-98249",
"created_at": "2022-09-04T14:36:18.357719Z",
"updated_at": "2022-09-04T14:36:18.357733Z",
"structure_string": "Rb8 Sb4 Au4 S16\n1.0\n6.727327 -0.000000 0.000000\n0.000000 7.203863 0.000000\n0.000000 0.000000 20.203469\nRb Sb Au S\n8 4 4 16\ndirect\n0.299449 0.750000 0.011911 Rb\n0.909498 0.250000 0.670910 Rb\n0.700552 0.250000 0.988089 Rb\n0.299449 0.250000 0.488089 Rb\n0.090502 0.750000 0.329090 Rb\n0.090502 0.250000 0.170910 Rb\n0.700552 0.750000 0.511911 Rb\n0.909498 0.750000 0.829090 Rb\n0.793568 0.750000 0.109549 Sb\n0.793568 0.250000 0.390451 Sb\n0.206432 0.250000 0.890451 Sb\n0.206432 0.750000 0.609549 Sb\n0.597138 0.500000 0.250000 Au\n0.402862 0.500000 0.750000 Au\n0.597138 0.000000 0.250000 Au\n0.402862 0.000000 0.750000 Au\n0.801652 0.750000 0.993108 S\n0.897187 0.750000 0.662413 S\n0.399123 0.523862 0.864325 S\n0.600877 0.023862 0.135675 S\n0.399123 0.476138 0.635675 S\n0.198348 0.750000 0.493108 S\n0.897187 0.250000 0.837587 S\n0.198348 0.250000 0.006892 S\n0.600877 0.976137 0.364325 S\n0.102814 0.250000 0.337587 S\n0.399123 0.023862 0.635675 S\n0.801652 0.250000 0.506892 S\n0.600877 0.523862 0.364325 S\n0.102814 0.750000 0.162413 S\n0.600877 0.476138 0.135675 S\n0.399123 0.976137 0.864325 S\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S-Sb",
"density": 4.191880914806384,
"density_atomic": 0.03268255866941771,
"volume": 979.1155069490809,
"volume_molar": 18.426160634831636,
"formula_full": "Rb8 Sb4 Au4 S16",
"formula_reduced": "Rb2SbAuS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.03596545875,
"spacegroup": 57
},
{
"id": "jvasp-121956",
"created_at": "2022-09-04T14:38:53.957734Z",
"updated_at": "2022-09-04T14:38:53.957759Z",
"structure_string": "Rb8 Sb1 O3\n1.0\n7.300421 -0.000000 0.000000\n0.000000 7.300421 0.000000\n-0.000000 -0.000000 7.300421\nRb Sb O\n8 1 3\ndirect\n0.269688 0.269688 0.269688 Rb\n0.730312 0.730312 0.269688 Rb\n0.730312 0.269688 0.730312 Rb\n0.269688 0.730312 0.730312 Rb\n0.269688 0.269688 0.730312 Rb\n0.730312 0.730312 0.730312 Rb\n0.730312 0.269688 0.269688 Rb\n0.269688 0.730312 0.269688 Rb\n0.000000 0.000000 0.000000 Sb\n-0.000000 0.500000 0.500000 O\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Sb",
"O"
],
"chemical_system": "O-Rb-Sb",
"density": 3.6425809428211435,
"density_atomic": 0.030841644645512516,
"volume": 389.0843091516525,
"volume_molar": 19.526003976821727,
"formula_full": "Rb8 Sb1 O3",
"formula_reduced": "Rb8SbO3",
"formula_anonymous": "AB3C8",
"energy_above_hull": 0.0697772166666666,
"spacegroup": 221
},
{
"id": "jvasp-4885",
"created_at": "2022-09-04T14:37:14.172200Z",
"updated_at": "2022-09-04T14:37:14.172216Z",
"structure_string": "Rb8 S20\n1.0\n6.564273 0.000000 0.000000\n0.000000 6.850009 0.000000\n0.000000 0.000000 17.519980\nRb S\n8 20\ndirect\n0.424898 0.749883 0.338433 Rb\n0.924898 0.750117 0.661567 Rb\n0.575101 0.249883 0.161567 Rb\n0.075101 0.250117 0.838433 Rb\n0.885801 0.581425 0.014689 Rb\n0.385802 0.918576 0.985311 Rb\n0.114198 0.081425 0.485311 Rb\n0.614198 0.418575 0.514689 Rb\n0.909352 0.080209 0.024197 S\n0.430982 0.869579 0.623854 S\n0.930982 0.630422 0.376146 S\n0.945052 0.386428 0.303216 S\n0.069017 0.130422 0.123854 S\n0.445052 0.113572 0.696784 S\n0.409352 0.419791 0.975803 S\n0.569017 0.369578 0.876146 S\n0.090648 0.580209 0.475803 S\n0.745911 0.832111 0.848799 S\n0.254089 0.332111 0.651201 S\n0.754088 0.167889 0.348799 S\n0.554948 0.613572 0.803216 S\n0.245911 0.667889 0.151201 S\n0.952028 0.247198 0.656920 S\n0.452028 0.252802 0.343080 S\n0.047972 0.747198 0.843080 S\n0.547971 0.752802 0.156920 S\n0.590647 0.919791 0.524197 S\n0.054948 0.886428 0.196784 S\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Rb",
"S"
],
"chemical_system": "Rb-S",
"density": 2.7929778419888214,
"density_atomic": 0.03554239169065436,
"volume": 787.7916670239841,
"volume_molar": 16.943543958476724,
"formula_full": "Rb8 S20",
"formula_reduced": "Rb2S5",
"formula_anonymous": "A2B5",
"energy_above_hull": 1.300472857142857,
"spacegroup": 19
}
]
}