A wide range of input keywords and data blocks are recognized by CASTEP, including some that are not accessible from the CASTEP setup dialogs.
All of the keywords and data blocks used in both the
.cell CASTEP input files are listed in alphabetical
order in the CASTEP keyword glossary.
In addition, separate lists, grouped by function, of the keywords in the
and the keywords and data blocks in the
.cell file are also available.
The keywords and keyword blocks in the input files are not case-sensitive.
CASTEP file formats
CASTEP keyword glossary
CASTEP parameters keywords
CASTEP cell keywords and data blocks