frequencies for isotopically substituted molecule?

From: Mark Saeys <mark.saeys_at_email.domain.hidden>
Date: Fri, 11 May 2001 15:37:42 +0200
X-Mailer: Microsoft Internet-e-mail/MAPI - 8.0.0.4211

Dear colleagues,

I did a frequency calculation in ADF1999. Now I would like to use this
result to calculate the frequencies for the same molecule in which the
hydrogen atoms are isotopically substituted by deuterium. Is there an
option in ADF to do this?

Thanks,

Mark
Received on 2001-05-11 15:41:38

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