DIPOLE_CORRECTION (.param)

Keyword type

String

Description

This keyword specifies the type of dipole correction to apply. Available options are:

It is recommended that a minimum of 8 Å vacuum is used throughout.

Default

NONE

Example

DIPOLE_CORRECTION : SELFCONSISTENT
See Also:

DIPOLE_DIR keyword
CASTEP keyword glossary
CASTEP parameters keywords

Accelrys Materials Studio 8.0 Help: Wednesday, December 17, 2014
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