Detail information of SiO2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	SiO2
Full formula	Si16O32
Tags	Silicon dioxide; Zeolite
Constituent elements	O; Si;
Number of elements	2
Number of sites	48
Volume	625.47317 Å³
Density	2.55224 g/cm³
Source	Materials Project

Space group

Spacegroup Number	126
Hermann Mauguin	P4/nnc
Hall	P 4 2 -1n
Crystal System	Tetragonal

Lattice Parameters

a	4.966 Å	b	11.222 Å	c	11.222 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
-327.81987 eV	-6.82958 eV	-2.19897 eV	0.30200 eV	0.00000 eV	1.08568 eV