Detail information of CoPH4ClO3 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	CoPH4ClO3
Full formula	Co8P8H32Cl8O24
Tags	Cobalt phosphinate chloride hydrate
Constituent elements	Cl; Co; H; O; P;
Number of elements	5
Number of sites	80
Volume	956.87670 Å³
Density	2.46270 g/cm³
Source	Materials Project

Space group

Spacegroup Number	61
Hermann Mauguin	Pbca
Hall	-P 2ac 2ab
Crystal System	Orthorhombic

Lattice Parameters

a	7.466 Å	b	13.404 Å	c	9.562 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
-408.06404 eV	-5.10080 eV	-1.34542 eV	3.09000 eV	24.00000 eV	0.10777 eV