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Dissipative Particle Dynamics with Energy Conservation

J. Bonet Avalos·A. D. Mackie
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Abstract

The stochastic differential equations for a model of dissipative particle dynamics with both total energy and total momentum conservation in the particle-particle interactions are presented. The corresponding Fokker-Planck equation for the evolution of the probability distribution for the system is deduced together with the corresponding fluctuation-dissipation theorems ensuring that the ab initio chosen equilibrium probability distribution for the relevant variables is a stationary solution. When energy conservation is included, the system can sustain temperature gradients and heat flow can be modeled.

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BibTeXRIS

J. Bonet Avalos, A. D. Mackie. 1997-06-20. Dissipative Particle Dynamics with Energy Conservation. https://doi.org/10.1209/epl%2Fi1997-00436-6

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