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Imaginary Frequencies #718

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cryos opened this issue Mar 21, 2013 · 1 comment
Open

Imaginary Frequencies #718

cryos opened this issue Mar 21, 2013 · 1 comment
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cryos commented Mar 21, 2013

When viewing Vibrations in Avogadro, imaginary frequencies appear to be omitted from the list. Any ideas on why this is the case?

Reported by: *anonymous
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cryos commented Jun 5, 2013

To answer your question: from what I have read this is caused by openbabel removing frequencies while opening the file (apparently Avogadro is depended on openbabel for that).

Developers: PLEASE get a workaround working for this. Viewing imaginary vibrational modes is a required part of the process for chemical research.

Original comment by: *anonymous

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