Extracting high-dimensional free energy surfaces from molecular simulations to accurately estimate the rate of physical and chemical processes B. De Bruyn Master of Science in Engineering Physics2023Supervisors Prof. Dr. ir. L. Vanduyhuys; Prof. Dr. ir. V. Van Speybroeck Read more about Extracting high-dimensional free energy surfaces from molecular simulations to accurately estimate the rate of physical and chemical processes
Implementation of classical density functional theory to unravel the fluid structure of adsorbed species in nanoporous materials V. De Ridder Master of Science in Engineering Physics2021Supervisors Prof. Dr. ir. L. Vanduyhuys; Prof. Dr. ir. V. Van Speybroeck Read more about Implementation of classical density functional theory to unravel the fluid structure of adsorbed species in nanoporous materials