Molecular simulation studies on thermophysical properties : with application to working fluids

• Main Author: Raabe, Gabriele (Author)
• Format: Electronic eBook
• Language: English
• Published: Singapore : Springer, [2017]
• Series: Molecular modeling and simulation.
• Subjects: Materials > Thermal properties.; Statistical mechanics.; elektronické knihy; electronic books

This book discusses the fundamentals of molecular simulation, starting with the basics of statistical mechanics and providing introductions to Monte Carlo and molecular dynamics simulation techniques. It also offers an overview of force-field models for molecular simulations and their parameterizati...