On Tue, Oct 2, 2012 at 2:01 AM, Sindrila Dutta banik <
sindrila.duttabanik.yahoo.com> wrote:
>
> Please tell me the significance of ntx=7 and the difference between ntx=5
> and ntx=7.
>
I think they are the same. I've never observed a difference between their
behaviors. Indeed, setting ntx=7 or 5 will use velocities from the
previous restart file, and must be used in conjunction with irest=1.
HTH,
Jason
--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
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Received on Tue Oct 02 2012 - 05:00:03 PDT
