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],
"chemical_system": "S-Sb",
"density": 4.515056954114765,
"density_atomic": 0.04001929341726501,
"volume": 499.7589485518417,
"volume_molar": 15.048093671243942,
"formula_full": "Sb8 S12",
"formula_reduced": "Sb2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.83011044,
"spacegroup": 62
},
{
"id": "jvasp-41032",
"created_at": "2022-09-04T14:37:47.357715Z",
"updated_at": "2022-09-04T14:37:47.357745Z",
"structure_string": "Ba4 In2 Bi2 S10\n1.0\n-4.206680 0.000000 -0.000000\n-2.103340 9.244001 -0.000000\n0.000000 -0.000000 -12.850418\nBa In Bi S\n4 2 2 10\ndirect\n0.130260 0.739478 0.189194 Ba\n0.887736 0.224528 0.314629 Ba\n0.869740 0.260522 0.689195 Ba\n0.112264 0.775471 0.814629 Ba\n0.444765 0.110469 0.055789 In\n0.555235 0.889530 0.555789 In\n0.217170 0.565660 0.478415 Bi\n0.782830 0.434340 0.978415 Bi\n0.495259 0.009479 0.725298 S\n0.684504 0.630992 0.632931 S\n0.358932 0.282136 0.499219 S\n0.045604 0.908792 0.446759 S\n0.641068 0.717863 0.999219 S\n0.504741 0.990520 0.225296 S\n0.315496 0.369007 0.132931 S\n0.284140 0.431718 0.833798 S\n0.715860 0.568282 0.333798 S\n0.954397 0.091208 0.946759 S\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ba",
"In",
"Bi",
"S"
],
"chemical_system": "Ba-Bi-In-S",
"density": 5.042858299660473,
"density_atomic": 0.03602100203749611,
"volume": 499.7084751074631,
"volume_molar": 16.718415422567215,
"formula_full": "Ba4 In2 Bi2 S10",
"formula_reduced": "Ba2InBiS5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.0804618011111111,
"spacegroup": 36
}
]
}