Dynamic simulations of water at constant chemical potential
نویسندگان
چکیده
منابع مشابه
Dynamic simulations of water at constant chemical potential
The grand molecular dynamics (GMD) method has been extended and applied to examine the density dependence of the chemical potential of a three-site water model. The method couples a classical system to a chemical potential reservoir of particles via an ansatz Lagrangian. Equilibrium properties such as structure and thermodynamics, as well as dynamic properties such as time correlations and diff...
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ژورنال
عنوان ژورنال: The Journal of Chemical Physics
سال: 1992
ISSN: 0021-9606,1089-7690
DOI: 10.1063/1.462169