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SY2

Structure

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Unit cell
Axis x y z Periodic
1 3.287 -1.898 0.000 True
2 0.000 3.795 0.000 True
3 0.000 0.000 6.276 True
Lengths: 3.7953.7956.276
Angles: 90.00090.000120.000

Interactive Convex Hull

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

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

Properties

Key Description Value
N_excess N_excess 4.000
band0 band0 58.619
full_dft_e_hull full_dft_e_hull 0.030
composition composition Y2S1
e10 e10 66.359
space_group_number space_group_number 164
chemsys chemsys S-Y
electride electride True
volume Volume of unit cell 78.287 ų
e0025 e0025 40.489
mattersim_e_hull mattersim_e_hull 0.009
band1 band1 67.196
pearson_symbol pearson_symbol hP3
e05 e05 60.388
natoms Number of atoms 3
band_gap band_gap 0.000
dft_e_hull dft_e_hull 0.030
formula Chemical formula Y2S