In the past few decades, numerous heat conduction models extending beyond Fourier's
have been developed to account for large gradients, fast phenomena, wave propagation …

In this review a systematic analysis of the potential energy landscape (PEL) of glass-forming
systems is presented. Starting from the thermodynamics, the route towards the dynamics is …

This introductory textbook covers all aspects of catalysis. It also bridges computational
methods, industrial applications and green chemistry, with over 600 references. The book is …

Nucleation is the initial step of every first-order phase transition, and most phase transitions
encountered both in everyday life and industrial processes are of the first-order. Using an …

The aim of this Tutorial is to help new researchers understand how to perform molecular
dynamics (MD) simulations of the shock response of materials and to provide a brief …

We review recent results from computer simulation studies of polymer glasses, from the
chain dynamics around the glass transition temperature Tg to the mechanical behaviour …

This review is focused on molecular momentum transport at fluid-solid interfaces mainly
related to microfluidics and nanofluidics in micro-/nano-electro-mechanical systems …

We survey results of computer simulations for the structure and dynamics of supercooled
polymer melts and films. Our survey is mainly concerned with features of a coarse grained …

The low thermal conductivity of polymers limits their heat spreading capability, which is one
of the major technical barriers for the polymer-based products, especially electronics, such …

A model for gas transport in micro fractures of shale and tight gas reservoirs is established.
Slip flow and Knudsen diffusion are coupled together to describe general gas transport …