SYMMETRY_TOL (.cell)

Keyword type

Real

Description

This keyword controls the tolerance within which symmetry will be considered to be satisfied. If an ion is found within this distance of its symmetric position, the symmetry will be considered to be satisfied.

Default

0.01 ang

Example

SYMMETRY_TOL : 0.25 ang

See Also:

CASTEP keyword glossary
CASTEP cell keywords and data blocks