[gmx-users] Re: About Temperature coupling and Energy Transfer....

cyberjhon cyberjhon at hotmail.com
Wed Nov 28 06:11:27 CET 2012


Dear Justin

Thanks for your answer.

I know what you mean, but the problem is that this is not 
a possible physical (real) behaviour.

If the temperature is not controlled as you said, the energy should continue 
growing not stop, but in these case after 50ps it reaches some kind of
equilibrium 
and stabilize. 

So why this is happening? Can you give me with a Physical or
and Algorithmic answer?

Thanks

John Michael



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