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P4Y6

Structure

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Unit cell
Axis x y z Periodic
1 3.965 0.000 0.000 True
2 0.000 5.580 0.000 True
3 0.000 0.000 11.741 True
Lengths: 3.9655.58011.741
Angles: 90.00090.00090.000

Interactive Convex Hull

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

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

Properties

Key Description Value
N_excess N_excess 3.000
band0 band0 0.000
full_dft_e_hull full_dft_e_hull 0.039
composition composition Y3P2
e10 e10 42.099
space_group_number space_group_number 71
chemsys chemsys P-Y
electride electride True
volume Volume of unit cell 259.746 ų
e0025 e0025 0.000
mattersim_e_hull mattersim_e_hull 0.014
band1 band1 50.497
pearson_symbol pearson_symbol oI10
e05 e05 50.661
natoms Number of atoms 10
band_gap band_gap 0.000
dft_e_hull dft_e_hull 0.031
formula Chemical formula Y6P4