J. Wieme

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

ISBN/ISSN:
Invited talk

Conference / event / venue 

CECAM workshop: Multi-scale modelling of flexible and disordered porous materials
Paris, France
Monday, 11 June, 2018 to Wednesday, 13 June, 2018

Towards a molecular level understanding of chemical and physical phenomena in metal-organic frameworks

ISBN/ISSN:
Talk

Conference / event / venue 

Congrès français des MOFs
Paris, France
Wednesday, 16 May, 2018 to Thursday, 17 May, 2018

Modelling phase transitions in temperature-responsive flexible metal-organic frameworks: the delicate balance between dispersion and entropy

ISBN/ISSN:
Talk

Conference / event / venue 

From Electrons to Phase Transitions
Vienna, Austria
Wednesday, 4 April, 2018 to Friday, 6 April, 2018

Elucidating the Vibrational Fingerprint of the Flexible Metal-Organic Framework MIL-53(Al) Using a Combined Experimental/Computational Approach

ISBN/ISSN:
Poster

Conference / event / venue 

MolSim 2018
Amsterdam, The Netherlands
Thursday, 11 January, 2018

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