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Treatment of Solvation Effects with COSMO
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Counterpoise Correction and COSMO
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Topic: Counterpoise Correction and COSMO (Read 9642 times)
kritsana
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Counterpoise Correction and COSMO
«
on:
May 12, 2010, 04:00:19 PM »
Hi,
I am not an expert in COSMO calculations. Is there any way to perform counterpoise correcitons (Boys and Bernardi) in continuum solvent.
Is there any study on this problem.
Thanks,
Kris..
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TURBOMOLE Users Forum
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TURBOMOLE Modules
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Treatment of Solvation Effects with COSMO
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Counterpoise Correction and COSMO