C. Weinberger – Multiscale Materials Modeling for Nanomechanics (2016)

Автор: C. Weinberger
Название книги: Multiscale Materials Modeling for Nanomechanics
Формат: PDF
Жанр: Нанотехнологии
Страницы: 554
Качество: Изначально компьютерное, E-book

Multiscale Materials Modeling for Nanomechanics is an interesting title for a book as the terms “nanomechanics” and “multiscale modeling” have different definitions and meaning to various scientific communities. Therefore, we feel it is important to inform the reader up front of our thoughts on this topic and why we chose to include the subjects discussed herein. We think of nanomechanics as the mechanics that occur at the smallest length scales in materials, down to nanometers. Thus, the study of nanomechanics should focus on materials where this regime of mechanics dominates or controls behavior, usually when a governing length scale is below a micron. In addition, it is our intent with a book on nanomechanics to focus equally on the materials as on the mechanics, because they are intrinsically linked at these size scales.
Contents
Introduction to Atomistic Simulation Methods
Fundamentals of Dislocation Dynamics Simulations
Continuum Approximations
Density Functional Theory Methods for Computing and Predicting Mechanical Properties
The Quasicontinuum Method: Theory and Applications
A Review of Enhanced Sampling Approaches for Accelerated Molecular Dynamics
Principles of Coarse-Graining and Coupling Using the Atom-to-Continuum Method
Concurrent Atomistic-Continuum Simulation of Defects in Polyatomic Ionic Materials
Continuum Metrics for Atomistic Simulation Analysis
Visualization and Analysis Strategies for Atomistic Simulations
Advances in Discrete Dislocation Dynamics Modeling of Size-Affected Plasticity
Modeling Dislocation Nucleation in Nanocrystals
Quantized Crystal Plasticity Modeling of Nanocrystalline Metals
Kinetic Monte Carlo Modeling of Nanomechanics in Amorphous Systems
Nanomechanics of Ferroelectric Thin Films and Heterostructures.
Modeling of Lithiation in Silicon
Multiscale Modeling of Thin Liquid Films
Appendix: Available Software and Codes