[Pw_forum] pp.x getting stuck, taking long time
Henry J Seeley
hseeley at uoregon.edu
Sun Oct 25 01:59:56 CEST 2015
Dear Users,
I've been using pp.x to obtain ILDOS/PDOS/PSI^2 information, and I'm a
little surprised by how long it takes for the processing to finish. I've
used a variety of the pp.x features, and although each pp.x takes only a
couple minutes to finish, when running many of them to obtain specialty
information I find myself waiting days.
The processing gets stuck between the outputs:
" negative rho (up, down): 1.581E-03 0.000E+00"
and
" negative rho (up, down): 1.581E-03 0.000E+00".
I'm sorry if this isn't enough information to solve this issue, but I'm
hoping this is a simple fix for something I'm overlooking.
Thank you for your help,
Hank Seeley
PhD student, chemistry
University of Oregon
More information about the users
mailing list