Molecular Simulation Studies on Thermophysical Properties With Application to Working Fluids /

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...

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Detaylı Bibliyografya
Yazar: Raabe, Gabriele (Yazar)
Müşterek Yazar: SpringerLink (Online service)
Materyal Türü: e-Kitap
Dil:İngilizce
Baskı/Yayın Bilgisi: Singapore : Springer Nature Singapore : 2017.
Imprint: Springer,
Edisyon:1st ed. 2017.
Seri Bilgileri:Molecular Modeling and Simulation, Applications and Perspectives,
Konular:
Thermodynamics.
Heat engineering.
Heat transfer.
Mass transfer.
Fluid mechanics.
Atomic structure  .
Molecular structure .
Engineering Thermodynamics, Heat and Mass Transfer.
Engineering Fluid Dynamics.
Atomic and Molecular Structure and Properties.
Online Erişim:Full-text access
İçindekiler:
  • Introduction
  • Introduction to Statistical Mechanics
  • Monte Carlo Simulations
  • Molecular Dynamics Simulations
  • Running Molecular Simulations
  • Molecular Models (Force Fields)
  • Thermophysical and Structural Properties from Molecular Simulation
  • Applications of Molecular Simulations to Studies on Working Fluids
  • Conclusion and Outlook
  • A Force Field Parameters.

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