Molecular simulation of alkane and alkene diffusion in nanoporous membranes to allow for an energy-efficient separation. B. Schmidt, L. Vanduyfhuys, V. Van Speybroeck ISBN/ISSN:PosterConference / event / venue Fears 2022Gent + BelgiumFriday, 28 October, 2022 Read more about Molecular simulation of alkane and alkene diffusion in nanoporous membranes to allow for an energy-efficient separation.
Machines learning MOFs: training time-lagged autoencoders to learn collective variables for accurate free energy surfaces and transition kinetics Read more about Machines learning MOFs: training time-lagged autoencoders to learn collective variables for accurate free energy surfaces and transition kinetics