Detail information of CuP2(HO3)2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	CuP2(HO3)2
Full formula	Cu4P8H8O24
Tags	Copper dihydrogenphosphate(III)
Constituent elements	Cu; H; O; P;
Number of elements	4
Number of sites	44
Volume	554.14024 Å³
Density	2.67903 g/cm³
Source	Materials Project

Space group

Spacegroup Number	14
Hermann Mauguin	P21/c
Hall	-P 2ybc
Crystal System	Monoclinic

Lattice Parameters

a	7.442 Å	b	9.926 Å	c	7.633 Å
α	90.000°	β	100.629°	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
-251.01579 eV	-5.70490 eV	-1.45144 eV	0.00000 eV	3.99993 eV	0.53686 eV