CASTEP
Documentation
The following guides are available:
- Geometry Optimisation
- Molecular Dynamics
- A brief introduction to CASTEP MD
- User Guide for Phonons and Related Calculations
- A rough guide to ELNES/EELS calculations using CASTEP
- On-The-Fly Pseudopotential Generation in CASTEP
- Some additional notes on the OTF generation string
CASTEP Documentation from Materials Studio - created by Accelrys.
Keywords
CASTEP has a built in help system. To get more information on using castep use:
castep -help
Alternatively you can search for help on a particular topic
castep -help search keyword
or list all of the input parameters
castep -help search all
Full lists of all input parameters can be found in the Accelrys documentation