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P₄Ca₁₀

Structure

If the GUI button does not open remotely, use the 3D view above or download the structure.

Unit cell

Axis	x	y	z	Periodic
1	4.542	0.000	0.000	True
2	0.000	9.618	0.000	True
3	0.000	0.000	9.572	True

Lengths:	4.542	9.618	9.572
Angles:	90.000	90.000	90.000

Interactive Convex Hull

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

Binary

Generating convex hull for Ca-P…

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	30.182
full_dft_e_hull	full_dft_e_hull	0.154
composition	composition	Ca5P2
e10	e10	48.684
space_group_number	space_group_number	31
chemsys	chemsys	Ca-P
electride	electride	True
volume	Volume of unit cell	418.147 Å³
e0025	e0025	7.978
mattersim_e_hull	mattersim_e_hull	-0.071
band1	band1	48.220
pearson_symbol	pearson_symbol	oP14
e05	e05	48.265
natoms	Number of atoms	14
band_gap	band_gap	0.097
dft_e_hull	dft_e_hull	0.001
formula	Chemical formula	Ca10P4