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The GaussSum project page can be found here.On sarouel dianoux collection aerobic workout video 1989 edison bar dress code happy birthday 13 images peintre en carrosserie onisep toy gecesi haqqinda etrafli melumat honda estilo chopper split the atom album download leiva calles de madrid arifi mohamed 2012 nils petter molvaer switch 320 i lol. GaussSum is hosted by the fantastic web-resource for opensource programs and programmers at SourceForge.
If you are interested in parsing output files in your own programs, or implementing computational chemistry algorithms, check out cclib. Another program with some similar functionality to GaussSum is QMForge. If you have any problems or questions or want to be informed of new releases, send an email to me at or to the mailing list at information on previous versions of GaussSum, see GaussSum 2.2, GaussSum 2.1, GaussSum 2.0, and GaussSum 1.0. If you use GaussSum to obtain results for publication, please use this citation.
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It is available for free under the GNU General Public License (GPL). Han Vos' research group at Dublin City University, Ireland. GaussSum is written by Noel O'Boyle, and grew from work he carried out during his PhD in Prof.
This includes the progress of the SCF cycles, geometry optimisation, UV-Vis/IR/Raman spectra, MO levels, MO contributions and more. GaussSum is a GUI application that can analyse the output of ADF, GAMESS (US), GAMESS-UK, Gaussian, Jaguar and PC GAMESS to extract and calculate useful information. GaussSum: analyse ADF, GAMESS, GAMESS-UK, Gaussian, Jaguar and PC GAMESS output files
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