Detail information of Ti3(BiO3)4 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	Ti3(BiO3)4
Full formula	Ti6Bi8O24
Tags	Tetrabismuth trititanate
Constituent elements	Bi; O; Ti;
Number of elements	3
Number of sites	38
Volume	503.94020 Å³
Density	7.72055 g/cm³
Source	Materials Project

Space group

Spacegroup Number	7
Hermann Mauguin	Pc
Hall	P -2yc
Crystal System	Monoclinic

Lattice Parameters

a	16.920 Å	b	5.454 Å	c	16.893 Å
α	90.000°	β	18.862°	γ	90.000°

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Style

Calculated Energies

Total energy	Energy per atom	Formation energy per atom	Band gap	Total magnetization	Energy above hull
-277.37046 eV	-7.29922 eV	-2.56112 eV	2.37150 eV	0.00207 eV	0.00652 eV