"The book contains the only available complete presentation of the mode-coupling theory (MCT) of complex dynamics of glass-forming liquids, dense polymer melts, and colloidal suspensions. It describes in a self-contained manner the derivation of the MCT equations of motion and e…
Amorphous condensed matter can exhibit complex motions on time scales which extend up to those relevant for the functioning of biomaterials. The book presents the derivation of a microscopic theory for amorphous matter, which exhibits the evolution of such complex motions as a n…
Nonadiabatic molecular dynamics (NAMD) simulation methods are useful for gauging the presence of and characterizing pathways for efficient nonradiative recombination (NRR), which can greatly reduce the efficacy of optoelectronic materials. This utility is herein applied to lead-…
In recent years there has been a great deal of interest in understanding the fundamental behaviour of granular materials. Granular materials are ubiquitous in natural and industrial settings however, their flow behaviour cannot be described using classical ideas of fluid flows a…
Chapters in this book begin with coverage of the concepts and methods for simpler systems, then move on to more advanced subjects for complex systems. Each chapter begins with qualitative aspects before these are treated in quantitative fashion. The first four chapters include t…
"Chapters in this book begin with coverage of the concepts and methods for simpler systems, then move on to more advanced subjects for complex systems. Each chapter begins with qualitative aspects before these are treated in quantitative fashion. The first four chapters include …
"Chapters in this book begin with coverage of the concepts and methods for simpler systems, then move on to more advanced subjects for complex systems. Each chapter begins with qualitative aspects before these are treated in quantitative fashion. The first four chapters include …
"Chapters in this book begin with coverage of the concepts and methods for simpler systems, then move on to more advanced subjects for complex systems. Each chapter begins with qualitative aspects before these are treated in quantitative fashion. The first four chapters include …
The range of conformational states that determine the function of a protein is often unknown. This is the case for most proteins. In particular, for membrane proteins, this is more challenging, as their structures are often difficult to resolve. At present, the computational pre…