CCL:G: IR spectra from Gaussian
- From: "Serdar Badoglu" <sbadoglu#gazi.edu.tr>
- Subject: CCL:G: IR spectra from Gaussian
- Date: Thu, 12 Mar 2009 03:43:28 -0400
Sent to CCL by: "Serdar Badoglu" [sbadoglu,,gazi.edu.tr]
Dear Chris,
I don't know if any such script/program exists. But here's an alternative way I
follow: Right click on the Gaussian03's IR spectrum graph and select "save
data". There you can also determine the initial and final wavenumbers which
you're interested in, and the stepsize as well. Extracted data will be saved as
a text file, later you can import those data to SigmaPlot or a similar
spreadsheet software (I always recommend to use scientific spreadsheet
programs).
Hope this helps,
Serdar Badoglu