[Gausssum-help] help

[Ajeet S. <aje...@gm...>]

By using GaussSum, log file was opened and chosen orbitals option and after
picked the DOS option. It will create the DOS spectrum. Up to this,
everything is fine. For PDOS, it is mandatory to create groups.txt file in
the same gausssum3 directory.  Whenever, I tried it to open, the software
displays an error message.








*Dr. Ajeet Singh*M.Sc., Ph.D.,
Division  of Advanced Materials Science,
POSTECH,
South Korea
e-mail: aje...@gm...
Google Scholar Page: http://scholar.google.co.in/citations?user=KDGOcbAAAAAJ