R. Demuynck
Towards modeling long-range disorder in MOFs: Development of a computational toolbox to extend the length scale in molecular simulations
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Talk
Conference / event / venue
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
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
ISBN/ISSN:
Talk
Conference / event / venue
The Goodwin Group
Oxford, United Kingdom
Monday, 22 July, 2019
Reliably modeling the mechanical stability of MOFs at increasing length scales to unleash their full industrial potential
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Talk
Conference / event / venue
MMC
Oxford, United Kingdom
Tuesday, 4 June, 2019
Systematically identifying the collective variables describing phase transformations in flexible materials
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Poster
Conference / event / venue
ML4MS
Helsinki, Finland
Monday, 6 May, 2019 to Friday, 10 May, 2019
Systematically identifying the collective variables describing phase transformations in flexible materials
ISBN/ISSN:
Poster
Conference / event / venue
MOFSIM
Ghent, Belgium
Wednesday, 10 April, 2019 to Friday, 12 April, 2019
Systematically identifying the collective variables describing phase transformations in flexible materials
ISBN/ISSN:
Poster
Conference / event / venue
MOLSIM2019
Amsterdam, Netherlands
Monday, 7 January, 2019 to Friday, 18 January, 2019
Construction of a Ready-to-Use Database to Enable Accurate High-Throughput Screenings of Covalent Organic Frameworks
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Poster
Conference / event / venue
MOFSIM2019
Ghent, Belgium
Wednesday, 10 April, 2019 to Friday, 12 April, 2019
Elucidating the dynamics of the intricate stacking behaviour in 2D covalent organic frameworks at finite temperatures using MD simulations
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Poster
Conference / event / venue
MOFSIM 2019
Ghent, Belgium
Thursday, 11 April, 2019