Detail information of CoPH3O4 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	CoPH3O4
Full formula	Co8P8H24O32
Tags	Cobalt hydrogenphosphate(III) hydrate
Constituent elements	Co; H; O; P;
Number of elements	4
Number of sites	72
Volume	737.12767 Å³
Density	2.82812 g/cm³
Source	Materials Project

Space group

Spacegroup Number	29
Hermann Mauguin	Pca21
Hall	P 2c -2ac
Crystal System	Orthorhombic

Lattice Parameters

a	9.050 Å	b	7.972 Å	c	10.217 Å
α	90.000°	β	90.000°	γ	90.000°

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Calculated Energies

Total energy	Energy per atom	Formation energy per atom	Band gap	Total magnetization	Energy above hull
-419.65872 eV	-5.82859 eV	-1.68488 eV	2.83620 eV	24.00000 eV	0.06315 eV