[gmx-users] Re: crazy temperatures

Dr. Vitaly V. Chaban vvchaban at gmail.com
Thu Mar 29 04:11:00 CEST 2012


> Dear GMCS users
>
> Hi. Does anyone know if MD at 20000K is feasible?

Aggregate state, not temperature, matters if you want to discuss
potential models applicability.

I believe at ~10,000K one can get quite realistic results for the
gaseous phase of certain high-melting substances like CaO or MgS.


Dr. Vitaly V. Chaban, 430 Hutchison Hall, Chem. Dept.
Univ. Rochester, Rochester, New York 14627-0216
THE UNITED STATES OF AMERICA



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