Hello all,
Just checking this : does the file mdvel contains velocities at t or at
t+dt/2 ?
I am asking this because the source file runmd.f contains the following
comment :
c
c Note: if the last printed energy from the previous trajectory was
c at time "t", then the restrt file has velocities at time
c t + 0.5dt, and coordinates at time t + dt
c----------------------------------------------------------------------------
c
but the manual does not mention the time at which velocity is saved, so
I considered it was t until today...
Thank you,
HAgop.
Received on Thu Dec 19 2002 - 08:04:55 PST
