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GaussSum
URL: http://gausssum.sourceforge.net/
Submitted: Sat Sep 06 2003
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CT: Science: Chemistry: Software: Physical and Theoretical: GaussSum
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Description:
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.