Firefly and PC GAMESS-related discussion club

Learn how to ask questions correctly  
We are NATO-free zone

Re: How can i optimize crystal structure.

Alex Granovsky

Dear Chaitanya,

sorry for some delay with my answer.
If you meant periodic boundary conditions,
then it is impossible to optimize
crystal structures with Firefly.

Kind regards,
Alex Granovsky

On Sat Jul 13 '13 12:16pm, K Chaitanya wrote
>Dear Prof. Alex A. Granovsky, Good Morning,

>Kindly let me know how can i write input for organic crystal structure. Is it possible to optimize crystal structure using Firefly.

>Thanking You,
>With Warm Regards,

[ Previous ] [ Next ] [ Index ]           Mon Jul 15 '13 3:33pm
[ Reply ] [ Edit ] [ Delete ]           This message read 976 times