[Pw_forum] MD simulation temperature
niladri patra
npatra2 at uic.edu
Thu Feb 7 23:49:37 CET 2013
Hi,
I would like to run a md simulation for a chemical reaction at 300K. I see
that there is a command "tempw=300" under $ions. I would like to confirm
that this is the right input to run MD at 300K.
Thank You,
Niladri Patra
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PhD candidate
Department of Chemistry
University of Illinois at Chicago
845 W Taylor St., Room 4500
Chicago, IL 60607
Tel. (312) 996-5393
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