inclusion of solvation effect
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inclusion of solvation effect
Is there any method to include an solvation (e.g., hydration) effect in VASP calculation job?
How about the use of hybrid method with TINKER or inclusion of implicit solvation model?
If so, would you let me know what I should do for it in detail, please?
Best regards,
Luke
How about the use of hybrid method with TINKER or inclusion of implicit solvation model?
If so, would you let me know what I should do for it in detail, please?
Best regards,
Luke
Last edited by luke419 on Wed Oct 06, 2010 8:15 am, edited 1 time in total.
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- Global Moderator
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Re: inclusion of solvation effect
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
Best wishes,
VASP