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"formula_reduced": "BaZnCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 60
},
{
"id": "jvasp-37580",
"created_at": "2022-09-04T14:37:29.390159Z",
"updated_at": "2022-09-04T14:37:29.390173Z",
"structure_string": "Sr4 Dy8 S16\n1.0\n3.985453 -0.000000 0.000000\n0.000000 11.962992 0.000000\n0.000000 0.000000 14.324351\nSr Dy S\n4 8 16\ndirect\n0.749999 0.243129 0.661710 Sr\n0.250000 0.256871 0.161710 Sr\n0.749999 0.743129 0.838290 Sr\n0.250000 0.756871 0.338290 Sr\n0.250000 0.420015 0.898898 Dy\n0.749999 0.079985 0.398899 Dy\n0.749999 0.579985 0.101101 Dy\n0.250000 0.920015 0.601101 Dy\n0.749999 0.070032 0.890555 Dy\n0.250000 0.929968 0.109445 Dy\n0.749999 0.570032 0.609445 Dy\n0.250000 0.429968 0.390555 Dy\n0.749999 0.791471 0.175374 S\n0.250000 0.914838 0.920592 S\n0.749999 0.585162 0.420592 S\n0.250000 0.208528 0.824626 S\n0.749999 0.291471 0.324626 S\n0.250000 0.708528 0.675374 S\n0.250000 0.131701 0.526320 S\n0.250000 0.521034 0.216220 S\n0.250000 0.631701 0.973680 S\n0.749999 0.868299 0.473680 S\n0.250000 0.021034 0.283780 S\n0.749999 0.478966 0.783780 S\n0.749999 0.085162 0.079408 S\n0.749999 0.978965 0.716220 S\n0.749999 0.368299 0.026320 S\n0.250000 0.414838 0.579408 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Sr",
"Dy",
"S"
],
"chemical_system": "Dy-S-Sr",
"density": 5.26038527243965,
"density_atomic": 0.040998273926540124,
"volume": 682.9555812561726,
"volume_molar": 14.688766582686748,
"formula_full": "Sr4 Dy8 S16",
"formula_reduced": "Sr(DyS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2723699014285714,
"spacegroup": 62
}
]
}