Theory and Modeling of Polymer Nanocomposites

Valeriy V. Ginzburg, Lisa M. Hall (Herausgeber)

Buch | Softcover

XIX, 316 Seiten

2021 | 1st ed. 2021
Springer International Publishing (Verlag)
978-3-030-60445-5 (ISBN)

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This edited volume brings together the state of the art in polymer nanocomposite theory and modeling, creating a roadmap for scientists and engineers seeking to design new advanced materials. The book opens with a review of molecular and mesoscale models predicting equilibrium and non-equilibrium nanoscale structure of hybrid materials as a function of composition and, especially, filler types. Subsequent chapters cover the methods and analyses used for describing the dynamics of nanocomposites and their mechanical and physical properties. Dedicated chapters present best practices for predicting materials properties of practical interest, including thermal and electrical conductivity, optical properties, barrier properties, and flammability. Each chapter is written by leading academic and industrial scientists working in each respective sub-field. The overview of modeling methodology combined with detailed examples of property predictions for specific systems will make this book usefulfor academic and industrial practitioners alike.

Introduction.- Part I. Structure and Morphology.- Chapter 1. Atomistic and Molecular Modeling of Polymer Nanocomposites.- Chapter 2. Coarse-grained modeling: Particle-based Approaches.- Chapter 3. Coarse-grained modeling: Field-based Approaches.- Chapter 4. Multiscale modeling examples.- Part II. Dynamics and Rheology.- Chapter 5. Diffusion in Polymer Nanocomposites.- Chapter 6. Linear Rheology of Polymer Nanocomposites.- Chapter 7. Nonlinear Rheology and Mechanics of Polymer Nanocomposites.- Part III. Physical Property Prediction.- Chapter 8. Thermal Conductivity.- Chapter 9. Electrical Conductivity.- Chapter 10. Optical Properties.- Chapter 11. Barrier Properties.- Chapter 12. Dielectric Breakdown.- Chapter 13. Flammability.- Summary.- Index.

Erscheinungsdatum	19.12.2021
Reihe/Serie	Springer Series in Materials Science
Zusatzinfo	XIX, 316 p. 150 illus., 130 illus. in color.
Verlagsort	Cham
Sprache	englisch
Maße	155 x 235 mm
Gewicht	516 g
Themenwelt	Naturwissenschaften ► Chemie ► Technische Chemie
Themenwelt	Technik ► Maschinenbau
Schlagworte	density functional theory • mechanical properties polymer nanocomposite • molecular dynamics polymer nanocomposite • molecular modeling polymer nanocomposite • monte carlo simulation polymer nanocomposite • nanostructure polymer nanocomposite • physical properties polymer nanocomposite • polymer reference interaction site model • Prism • self-consistent field theory • theory polymer nanocomposite
ISBN-10	3-030-60445-4 / 3030604454
ISBN-13	978-3-030-60445-5 / 9783030604455
Zustand	Neuware