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Al2S8Cs12

Structure

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Unit cell
Axis x y z Periodic
1 7.954 0.000 -2.667 True
2 0.000 14.623 0.000 True
3 0.000 0.000 8.792 True
Lengths: 8.38914.6238.792
Angles: 90.000108.53890.000

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 55.815
full_dft_e_hull full_dft_e_hull 0.019
composition composition Cs6Al1S4
e10 e10 59.095
space_group_number space_group_number 8
chemsys chemsys Al-Cs-S
electride electride True
volume Volume of unit cell 1022.655 ų
e0025 e0025 55.872
mattersim_e_hull mattersim_e_hull -0.096
band1 band1 0.000
pearson_symbol pearson_symbol mS22
e05 e05 58.292
natoms Number of atoms 22
dft_e_hull dft_e_hull -0.052
formula Chemical formula Al2Cs12S8