S.M.J. Rogge
Clear the way: Effect of linker defects in UiO-66 on the diffusion of CO2/CH4 mixtures
Application of flexible metal-organic frameworks as nanosized shock absorbers
Metal-organic frameworks under pressure: A thermodynamic exploration
ISBN/ISSN:
Talk
Conference / event / venue
MolSim 2016: Understanding Molecular Simulations
Amsterdam, The Netherlands
Friday, 8 January, 2016
Advanced molecular simulations to accurately characterize metal-organic frameworks
ISBN/ISSN:
Poster
Conference / event / venue
MolSim
Amsterdam, Netherlands
Monday, 4 January, 2016 to Friday, 15 January, 2016
Benchmarking free energy methods for breathing in Metal-Organic Frameworks
ISBN/ISSN:
Poster
Conference / event / venue
IAP Annual Meeting
Hasselt, Belgium
Friday, 11 September, 2015
Advanced molecular simulations to accurately characterize metal-organic frameworks
ISBN/ISSN:
Poster
Conference / event / venue
IAP Annual Meeting
Hasselt, Belgium
Friday, 11 September, 2015
Explicit sampling of the unit cell shape for a more accurate estimation of the free energy profile for flexible crystals
Master of Science in Physics and Astronomy
2016
Benchmarking free energy methods for breathing in Metal-Organic Frameworks
ISBN/ISSN:
Poster
Conference / event / venue
Hands-on workshop density-functional theory and beyond: First-principles simulations of molecules and materials
Berlin, Germany
Monday, 13 July, 2015 to Thursday, 23 July, 2015
Understanding The Flexibility In Metal-Organic Frameworks From molecular To Thermodynamic Insights
ISBN/ISSN:
Keynote
Conference / event / venue
CHITEL2015
Torino, Italy
Sunday, 26 July, 2015 to Friday, 31 July, 2015
Pages
