Molecular Dynamics Simulation
Zhou, Kun (Associate Professor, School of Mechanical and Aerospace Engineering, Nanyang Technological University (NTU), Singapore) / Liu, Bo (Associate Professor, School of Mechanical and Vehicle Engineering, Hunan University, China) Molecular Dynamic Simulation: Fundamentals and Applications explains the fundamentals of MD simulation and explores recent developments in advanced modeling approaches based on the MD method. The improvements in efficiency and accuracy delivered by this new research are explained to help readers apply them to a wide range of tasks. Details of the implementation of MD simulation are illustrated by presenting the applications of MD simulation in...