GaussSum
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Scan day: 09 February 2014 UTC
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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.
GaussSum: analyse ADF, GAMESS, GAMESS-UK, Gaussian, Jaguar and PC GAMESS output files is a GUI application that can analyse the output of to extract and calculate useful information. This includes the progress of the SCF cycles, geometry optimisation, UV-Vis/IR/Raman spectra, MO levels, MO contributions and more.
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WEBSITE Info
Page title: | GaussSum: analyse ADF, GAMESS, GAMESS-UK, Gaussian, Jaguar and PC GAMESS output files |
Keywords: | |
Description: | |
IP-address: | 216.34.181.96 |
WHOIS Info
NS | Name Server: NS1.P03.DYNECT.NET Name Server: NS2.P03.DYNECT.NET Name Server: NS3.P03.DYNECT.NET Name Server: NS4.P03.DYNECT.NET |
WHOIS | Status: clientTransferProhibited Status: clientUpdateProhibited |
Date | Creation Date: 08-aug-1999 Expiration Date: 08-aug-2015 |