Atomistic modeling of materials failure

Atomistic modeling of materials failure

Author
Markus J. Buehler
Publication Year
2008
Publisher
Springer
Language
English
Document Type
Book
Faculty / Subject Heading
Engineering

Atomistic Modeling of Materials Failure is an introduction to molecular and atomistic modeling techniques applied to solid deformation and fracture. Focusing on a variety of brittle, ductile and geometrically confined materials, this detailed overview includes computational methods at the atomic scale, and describes how these techniques can be used to model the dynamics of cracks, dislocations and other deformation mechanisms.


Keywords: Engineering / Atomistic elasticity / Atomistic modeling / Brittle materials / Continuum mechanics / Deformation / Ductile materials / Elasticity of polymers / Fracture phenomena / Interatomic potential / Materials deformation / Multi-scale modeling / Polymers / Stress tensor / Ther