CCL:G: G09 Keyword: Freq



 Sent to CCL by: Jens Spanget-Larsen [spanget===ruc.dk]
 Dear Andy:
 Application of Freq=(anharmonic,readanharm) may be quite tricky. I suggest you
 contact Fernando R. Clemente of Gaussian Technical Support
 (help.at.gaussian.com), he was very helpful when we had problems with this
 keyword/option in a recent investigation (Spanget-Larsen et al., Chemical
 Physics 389, 107-115 (2011)).
 Yours, Jens >--<
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 -----Original Message-----
 > From: owner-chemistry+spanget==ruc.dk{:}ccl.net [mailto:owner-chemistry+spanget==ruc.dk{:}ccl.net] On Behalf Of Andy Wong
 andy.wong%a%monash.edu
 Sent: 5. september 2014 15:10
 To: Jens Spanget-Larsen
 Subject: CCL:G: G09 Keyword: Freq
 Sent to CCL by: "Andy  Wong" [andy.wong[-]monash.edu] I am trying to
 use the Freq=(anharmonic,readanharm) keyword with the command PT2Model=GVPT2 in
 Gaussian 09. However the log file says that this is not a recognised command.
 Any help is appreciated.
 Regards
 Andy Wong
 andy.wong\a/monash.eduhttp://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp-:-//www.ccl.net/chemistry/sub_unsub.shtmlhttp-:-//www.ccl.net/spammers.txt