Low temperature Molecular Dynamics

From: Mert Gür (gurmert_at_gmail.com)
Date: Tue Sep 14 2010 - 15:42:53 CDT

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Dear all,

During minimization the temperature drops to 0K.

So, how meaningful would it to do a simulation at a lower temperature than
273.2K. Lets say at 100K.

I am asking because of the liquid/solid transformation that should happen at
273.2K.

Since I use water as a solvent,will it be supercooled?

Best,

Mert

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