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Al4Cs8S8

Structure

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Unit cell
Axis x y z Periodic
1 11.386 0.000 0.000 True
2 0.000 13.373 0.000 True
3 0.000 0.000 5.987 True
Lengths: 11.38613.3735.987
Angles: 90.00090.00090.000

Interactive Convex Hull

Automatically generated for Al-Cs-S using the curated electride and Materials Project reference phases.

Ternary
Generating convex hull for Al-Cs-S…
Hover for phase details, drag to zoom, and double-click to reset the view.

Properties

Key Description Value
N_excess N_excess 1.000
band0 band0 49.204
full_dft_e_hull full_dft_e_hull 0.064
composition composition Cs2Al1S2
e10 e10 50.366
space_group_number space_group_number 72
chemsys chemsys Al-Cs-S
electride electride True
volume Volume of unit cell 911.597 ų
e0025 e0025 0.000
mattersim_e_hull mattersim_e_hull -0.133
band1 band1 51.339
pearson_symbol pearson_symbol oI20
e05 e05 49.519
natoms Number of atoms 20
band_gap band_gap 0.000
dft_e_hull dft_e_hull -0.065
formula Chemical formula Al4Cs8S8