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- Go to Recent Experiments
- Select an experiment that has a "Complete" under Experiment Status
- Scroll Down and click on the output "Gaussian.log" file and it should download the file
- Under the "Molecular Editors" menu select Jamberoo
- Under "File" menu in Jamberoo Choose "Open As" → Gaussian→ Gaussian (03) Output
- From the file browser chose one of the logfiles from recent runs
available in SEAGrid → Experiment Data → Experiment Folder→ gaussian.log file - Depending on the run you have one or more choices ( for example opt freq runs result in two choices )
- For choice #2 corresponding to Freq run select this and
- Select OK
- Select OK again for the vibrational modes and Infrared spectrum
- A vibrational control panel should appear
- Select a Frequency of interest (highest)
- checkbox before "Animate Vibrations"
this should show vibrational mode - select displacement vectors and this should add displacement vector lines on atoms
- From the file browser chose one of the logfiles from recent runs
Under