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P₄Ba₈

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	4.664	0.000	0.000	True
2	0.000	8.065	0.000	True
3	0.000	0.000	16.226	True

Lengths:	4.664	8.065	16.226
Angles:	90.000	90.000	90.000

Interactive Convex Hull

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

Binary

Generating convex hull for Ba-P…

Hover for phase details, drag to zoom, and double-click to reset the view.

Properties

Key	Description	Value
N_excess	N_excess	1.000
band0	band0	54.100
full_dft_e_hull	full_dft_e_hull	0.003
composition	composition	Ba2P1
e10	e10	56.221
space_group_number	space_group_number	36
chemsys	chemsys	Ba-P
electride	electride	True
volume	Volume of unit cell	610.364 Å³
e0025	e0025	59.357
mattersim_e_hull	mattersim_e_hull	0.024
band1	band1	59.804
pearson_symbol	pearson_symbol	oS12
e05	e05	56.318
natoms	Number of atoms	12
band_gap	band_gap	0.000
dft_e_hull	dft_e_hull	-0.001
formula	Chemical formula	Ba8P4