GaussSum

5.0 Stars (4)
78 Downloads (This Week)
Last Update:
Download GaussSum-2.2.6.1.tar.gz
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Description

GaussSum parses the output of ADF, GAMESS, GAMESS-UK, and Gaussian to extract useful information: progress of geometry optimisation, UV/IR/Raman spectra, MO contributions and more.

GaussSum Web Site

Features

  • Convolute UV-Vis spectrum
  • IR and Raman visualization

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User Ratings

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User Reviews

  • dreamafox
    1 of 5 2 of 5 3 of 5 4 of 5 5 of 5

    Very useful. Thanks.

    Posted 06/07/2013
  • blaskrusik1978
    1 of 5 2 of 5 3 of 5 4 of 5 5 of 5

    very good project, thanks!

    Posted 04/06/2013
  • dpas82
    1 of 5 2 of 5 3 of 5 4 of 5 5 of 5

    Brilliant - simple and very useful (I can only attest to G03/G09). Does exactly what I need without any fuss.

    Posted 10/22/2012
  • johnnnybravo
    1 of 5 2 of 5 3 of 5 4 of 5 5 of 5

    Good work:)

    Posted 03/21/2012
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Additional Project Details

Languages

English

Intended Audience

Science/Research

Programming Language

Python

Registered

2003-08-23
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