Molecular Dynamics Simulation of Nanostructured Materials : An Understanding of Mechanical Behavior (Hardcover)

Chapter 1: Structural Description of Materials 1.1 Atomic arrangements in materials 1.2 Defects in solids 1.3 Fiber Reinforced Composite Materials References 　 Chapter 2: Mechanical Behavior of Materials 2.1 Elastic Deformation 2.2 Plastic deformation 2.3 Theory of Dislocation and Plastic deformation 2.4 Mechanical twinning 2.5 Macroscopic Plasticity 2.6 Grain boundary engineering 2.7 Grain misorientation and grain-boundary rotation dependent mechanical properties References Chapter 3: Creep and Fatigue behavior of Materials 3.1 Metallic creep and viscoelasticity 3.2 Deformation mechanism maps 3.3 Metallic fatigue 3.4 Fracture and toughness 3.5 Crack propagation and healing mechanism for metallic system 3.6 Strengthening and toughening mechanism of metallic system 3.7 Strengthening and toughening mechanism of polymeric composite system 3.8 Physics of Fiber-reinforced composite materials deformation References Chapter 4: Mechanical Behavior of Nanostructured Materials 4.1 Length Scale Dependent Mechanical Behavior 4.2 Categories of Nanostructured Materials 4.3 Non-equilibrium Nanostructured materials 4.4 Classification of Nanostructured materials based on Microstructure 4.5 Mechanical Properties of Nano Metallic Glass 4.6 Mechanical Properties of Nano granular Metallic Glasses 4.7 Interfacial and Mechanical Properties of Epoxy Nanocomposites References Chapter 5: Basics of Molecular Dynamics (MD) Simulation 5.1 Introduction 5.2　Molecular interactions 5.3 Interatomic Potentials 5.4　The MD algorithms 5.5　Time Dependence 5.6 Different ensembles 5.7 Structural characterization References Chapter 6: Stress-strain behavior investigation by MD Simulation 6.1. Introduction 6.2. Test Parameters 6.3. Test Procedure 6.4. Stress Strain plot 6.5. Structural Evolution 6.6. Summary References Chapter 7: Fracture simulations　using MD 7.1 Introduction 7.2 Test Parameters 7.3 Test Procedure 7.4 Traction and Separation Method 7.5　Crack Heal 7.6　Fracture Behavior Analysis 7.7　Summary References Chapter 8: Creep behavior investigation by MD Simulation 8.1 Introduction 8.2 Test parameters 8.3 Test Procedure 8.4 Creep curve plot 8.5 Structural evolution References 　 Chapter 9: Fatigue Behavior Investigation by MD Simulation 9.1 Introduction 9.2 Cyclic Loading Pattern 9.3 Test Parameters 9.4 Test Procedure 9.5 Structural Evolution 9.6 Impact of Cyclic Loading Pattern References