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"structure_string": "U8 V1 S17\n1.0\n4.158890 6.566946 0.000000\n-4.158890 6.566946 0.000000\n0.000000 1.959410 10.089023\nU V S\n8 1 17\ndirect\n0.817154 0.299759 0.298197 U\n0.299759 0.817154 0.298197 U\n0.182846 0.700241 0.701803 U\n0.700241 0.182846 0.701803 U\n0.204155 0.204155 0.543359 U\n0.795845 0.795845 0.456641 U\n0.682884 0.682884 0.982328 U\n0.317116 0.317116 0.017672 U\n0.000000 0.000000 0.000000 V\n0.821965 0.432715 0.534151 S\n0.432715 0.821965 0.534151 S\n0.178035 0.567285 0.465849 S\n0.567285 0.178035 0.465849 S\n0.941942 0.323254 0.029285 S\n0.323254 0.941942 0.029285 S\n0.058058 0.676746 0.970715 S\n0.676746 0.058058 0.970715 S\n0.212386 0.212386 0.279066 S\n0.787614 0.787614 0.720934 S\n0.061381 0.061381 0.771995 S\n0.938619 0.938619 0.228005 S\n0.302582 0.302582 0.754699 S\n0.697418 0.697418 0.245301 S\n0.521124 0.521124 0.830490 S\n0.478876 0.478876 0.169510 S\n0.000000 0.000000 0.500000 S\n",
"nsites": 26,
"nelements": 3,
"elements": [
"U",
"V",
"S"
],
"chemical_system": "S-U-V",
"density": 7.533856993229484,
"density_atomic": 0.04717950297746706,
"volume": 551.0867719911676,
"volume_molar": 12.764315815018602,
"formula_full": "U8 V1 S17",
"formula_reduced": "U8VS17",
"formula_anonymous": "AB8C17",
"energy": -214.63928532999995,
"energy_per_atom": -8.255357128076922,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -206.08828533,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 19.0000003,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:52.182000Z",
"spacegroup": 12
}
]
}