next up previous contents
Next: Example-5 GCMC in zeolites: Up: Examples Previous: Example-3 Use of post-code

Example-4 GCMC in zeolites: Methane

This is a simple example of GCMC. Methane molecules (United atoms) are inserted and deleted from the zeolite frame work. Zeolite is treated as rigid.


Last edited by Shaji Chempath on: 2008-06-26