VMD-L Mailing List

From: Rameswar Bhattacharjee (rameswariacs_at_gmail.com)
Date: Wed Jun 10 2020 - 23:01:30 CDT

Hi all,
I have a simulated periodic box of pentanol with very few amounts of water.
I have plotted the g(r) for OW-OW for the system using vmd and I got the
first peak at a very high value of g(r) (~80). It looks very odd to me. Is
there a normalization issue (bulk density) as I have few water molecules?
I am using lammps for the simulation. Any suggestion will be highly
appreciated. Thank you. 

-- 
*Regards*
*Rameswar*
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*Dr. Rameswar Bhattacharjee*
University of Delaware
*Newark, DE-19716*
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