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P4Y6

Structure

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Unit cell
Axis x y z Periodic
1 3.438 -1.985 0.000 True
2 0.000 3.970 0.000 True
3 0.000 0.000 18.885 True
Lengths: 3.9703.97018.885
Angles: 90.00090.000120.000

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 0.034
composition composition Y3P2
e10 e10 40.193
space_group_number space_group_number 164
chemsys chemsys P-Y
electride electride True
volume Volume of unit cell 257.776 ų
e0025 e0025 0.000
mattersim_e_hull mattersim_e_hull 0.035
band1 band1 40.441
pearson_symbol pearson_symbol hP10
e05 e05 38.359
natoms Number of atoms 10
band_gap band_gap 0.000
dft_e_hull dft_e_hull 0.026
formula Chemical formula Y6P4