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GaussSum

  Link Details for: GaussSum
Link Title: GaussSum Open in a new window
Link URL: http://gausssum.sourceforge.net/
Link Details: Collection of Python scripts which parse the output of Gaussian or GAMESS calculations to extract information such as the progress of the SCF cycles, geometry optimisation, UV-Vis/IR/Raman spectra, MO levels, and MO contributions.
Category: Top : Science : Chemistry : Software : Physical_and_Theoretical
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GaussSum