Detail information of CsMgH12(ClO2)3 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	CsMgH12(ClO2)3
Full formula	Cs2Mg2H24Cl6O12
Tags	Hexaaquamagnesium cesium chloride
Constituent elements	Cl; Cs; H; Mg; O;
Number of elements	5
Number of sites	46
Volume	642.95782 Å³
Density	1.91975 g/cm³
Source	Materials Project

Space group

Spacegroup Number	1
Hermann Mauguin	P1
Hall	P 1
Crystal System	Triclinic

Lattice Parameters

a	6.866 Å	b	13.707 Å	c	6.832 Å
α	89.934°	β	90.593°	γ	90.255°

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Calculated Energies

Total energy	Energy per atom	Formation energy per atom	Band gap	Total magnetization	Energy above hull
-214.49150 eV	-4.66286 eV	-1.59821 eV	4.91820 eV	0.00162 eV	0.00000 eV