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Modeling Quantum Effects on Adsorption and Diffusion of Hydrogen in Metal–Organic Frameworks

Authors: 
Giovanni Garberoglio
Abstract: 
In this book chapter, the principal numerical methods used to simulate adsorption and dynamics of hydrogen confined in nanoporous materials are reviewed.
Date of publication: 
20/04/2015
Published in: 
Metal-Organic Frameworks 6 (2015) 214