Detail information of NiH8(ClO2)2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	NiH8(ClO2)2
Full formula	Ni4H32Cl8O16
Tags	Nickel chloride tetrahydrate
Constituent elements	Cl; H; Ni; O;
Number of elements	4
Number of sites	60
Volume	619.58810 Å³
Density	2.16186 g/cm³
Source	Materials Project

Space group

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

Lattice Parameters

a	13.450 Å	b	9.451 Å	c	6.100 Å
α	90.000°	β	126.960°	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
-271.30441 eV	-4.52174 eV	-1.25696 eV	3.96930 eV	8.00000 eV	0.05055 eV