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P8Y12

Structure

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Unit cell
Axis x y z Periodic
1 7.495 0.000 0.000 True
2 0.000 4.010 0.000 True
3 0.000 0.000 15.542 True
Lengths: 7.4954.01015.542
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 27.756
full_dft_e_hull full_dft_e_hull 0.040
composition composition Y3P2
e10 e10 38.909
space_group_number space_group_number 62
chemsys chemsys P-Y
electride electride True
volume Volume of unit cell 467.151 ų
e0025 e0025 20.757
mattersim_e_hull mattersim_e_hull 0.028
band1 band1 28.553
pearson_symbol pearson_symbol oP20
e05 e05 40.229
natoms Number of atoms 20
band_gap band_gap 0.000
dft_e_hull dft_e_hull 0.032
formula Chemical formula Y12P8