IMPLICIT_SOLVENT_SURFACE_TENSION (.param)

Keyword type

Real

Description

This keyword specifies the solvent surface tension in the solvation model.

Default

4.7624e-05 Ha/Bohr2 corresponds to water as a solvent (equivalent to 0.0728 N/m)

Example

IMPLICIT_SOLVENT_SURFACE_TENSION : 0.0738 N/m
See Also:

CASTEP keyword glossary
CASTEP parameters keywords