https://github.com/muammar/frequencies

Extract IR frequencies from Gaussian output
https://github.com/muammar/frequencies

Last synced: 29 days ago
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Extract IR frequencies from Gaussian output

• Host: GitHub
• URL: https://github.com/muammar/frequencies
• Owner: muammar
• Created: 2015-08-02T22:47:52.000Z (over 9 years ago)
• Default Branch: master
• Last Pushed: 2018-07-25T16:29:19.000Z (over 6 years ago)
• Last Synced: 2023-04-04T12:19:31.049Z (over 1 year ago)
• Language: Python
• Homepage:
• Size: 198 KB
• Stars: 1
• Watchers: 2
• Forks: 0
• Open Issues: 0
• Metadata Files:
  • Readme: README.md

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README

        
# frequencies

This script takes the Gaussian output and write down the raw IR frequencies to be plotted.