[gmx-users] energy units?!

[David]

On Tue, 2004-04-27 at 21:08, Luciano wrote:
> Hi List, hi David ...I'm sorry! I would want to talk about energy
> calculate (and not energy units!). And about the conversion of the units
> ...?
> 
>  The MD protocol is:
> 
>  T = 50 K and P =1.0 bar
>  N = 150 Argon particles 
> 
which LJ parameters? What volume / density ?

The only interaction is LJ so that's easy enough.
>   
>  Thanks!
> 
>  Luciano
> 
> ######################################################
>                Luciano Tavares da Costa
>              Mestre em Engenharia Química
>    icq #232852036 ; ltcosta at universiabrasil.net  
>   Doutorando Laboratório de Espectroscopia Molecular
>               Instituto de Química - USP
>              
> ######################################################
> 
> 
> -----------------------------------------------------------------------
> Estamos quase lá e contamos com você para ganharmos o Prêmio iBest 2004
> da categoria Educação e Treinamento. Vote novamente no Universia
> nesta fase final e concorra a uma Chevrolet Montana Sport 0 Km.
> 
> 
> _______________________________________________
> gmx-users mailing list
> gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the 
> www interface or send it to gmx-users-request at gromacs.org.
-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assist. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++