T. Verstraelen

Non-covalent force field expressed in terms of spherical density functions

T. Verstraelen, S. Vandenbrande, F. Heidar-Zadeh, L. Vanduyfhuys, M. Waroquier, V. Van Speybroeck, P.W. Ayers
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255th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nexus of Food, Energy, and Water a
New Orleans, LA, USA
Sunday, 18 March, 2018 to Thursday, 22 March, 2018

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
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Hybrid Materials Group
Cambridge, United Kingdom
Wednesday, 21 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
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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
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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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