ELEC_RESTORE_FILE (.param)

Keyword type

String

Description

This keyword specifies the name of the file from which wavefunction and density data should be restored when performing a CONTINUATION or a REUSE run.

NULL means that wavefunction and density data will not be restored.

The basis set and distribution for the new run must be the same as those from the run in which the data file was written.

Default

NULL

Example

ELEC_RESTORE_FILE : test.wvfn

See Also:

ELEC_DUMP_FILE
CONTINUATION
REUSE
CASTEP keyword glossary
CASTEP parameters keywords