T. Verstraelen

Towards modeling long-range disorder in MOFs: Development of a computational toolbox to extend the length scale in molecular simulations

S.M.J. Rogge, R. Demuynck, G. Maurin, S. Vandenbrande, L. Vanduyfhuys, T. Verstraelen, M. Waroquier, J. Wieme, V. Van Speybroeck
ISBN/ISSN:
Talk

Conference / event / venue 

The Grey Group
Cambridge, United Kingdom
Tuesday, 20 August, 2019

Towards modeling long-range disorder in MOFs: Development of a computational toolbox to extend the length scale in molecular simulations

S.M.J. Rogge, R. Demuynck, G. Maurin, S. Vandenbrande, L. Vanduyfhuys, T. Verstraelen, M. Waroquier, J. Wieme, V. Van Speybroeck
ISBN/ISSN:
Talk

Conference / event / venue 

The Goodwin Group
Oxford, United Kingdom
Monday, 22 July, 2019

Understanding Noncovalent Interactions in Force Fields through Quantum Mechanics: Application to Gas Adsorption in Metal-Organic Frameworks

S. Vandenbrande
Wed, 08/05/2019
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent

https://biblio.ugent.be/publication/8615972

Supervisors

Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. ir. Toon Verstraelen

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