[gmx-users] The force (4.4) in page 50 of manual

Albert Sun albert_sun9 at yahoo.com
Mon May 24 18:46:06 CEST 2004


Dear Users,

I am unclear on the force (4.4) in  page 50 of Gromacs manual. 

The force (4.4) derived from L-J potential (4.3) has missed one rij^(-1).

Therefore the fist item in (4.4) should be rij^(-13)  and 

the 2nd item should rij^(-7).

Is it right?

Please advise.

Regards,

Albert

 

   


		
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