Pd-based composite membranes have received great attention from both academia and
industry as they exhibit significant potential in several important fields, such as hydrogen …

This book grew out of an idea to study properties of small subsystems of a large reservoir.
Observations were at the time not explainable with standard thermodynamics. But the theory …

The review concerns various aspects of application of the classical nonequilibrium
thermodynamics to the description of transfer processes in colloidal systems. Specific …

The low efficiency and high price of thermoelectric semiconductors has generated interest in
unconventional forms of thermoelectric materials. In this article, ionic thermoelectricity has …

An analytical model is developed to study the electrochemical characteristics of a solid oxide
electrolysis cell (SOEC) for carbon dioxide reduction, in which the activation overpotential …

Hydrogen separation with palladium-based membranes is considered as a promising
technology for pre-combustion CO2 capture as well as for industrial hydrogen production …

This chapter aims at providing an overall overview on the different approaches to modeling
the hydrogen mass transport through Pd-based membranes, paying particular attention to …

We have developed a classical molecular dynamics model for the hydrogen dissociation
reaction, containing two-and three-particle potentials derived by Kohen, Tully and Stillinger …

In recent years, the membrane technology has emerged as a competitive solution for CO 2
removal from natural gas. We present a detailed theoretical model to describe heat and …

We show how we can find the enthalpy of a chemical reaction under non-ideal conditions
using the Small System Method to sample molecular dynamics simulation data for …