Modeling Materials : Continuum, Atomistic and Multiscale Techniques (Hardcover)

1. Introduction; Part I. Continuum Mechanics and Thermodynamics: 2. Essential continuum mechanics and thermodynamics; Part II. Atomistics: 3. Lattices and crystal structures; 4. Quantum mechanics of materials; 5. Empirical atomistic models of materials; 6. Molecular statics; Part III. Atomistic Foundations of Continuum Concepts: 7. Classical equilibrium statistical mechanics; 8. Microscopic expressions for continuum fields; 9. Molecular dynamics; Part IV. Multiscale Methods: 10. What is multiscale modeling?; 11. Atomistic constitutive relations for multilattice crystals; 12. Atomistic/continuum coupling: static methods; 13. Atomistic/continuum coupling: finite temperature and dynamics; Appendix; References; Index.