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Re: How can i optimize crystal structure.

Alex Granovsky
gran@classic.chem.msu.su


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,
>Chaitanya


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