David Dubbeldam
Affiliations: | University of Amsterdam, Amsterdam, Netherlands |
Area:
Computational ChemistryWebsite:
http://molsim.chem.uva.nl/users/dubbeldam/index.htmlGoogle:
"David Dubbeldam"Mean distance: 9.8
Cross-listing: MathTree
Parents
Sign in to add mentor| Berend Smit | grad student | 2005 | Amsterdam | |
| (Computer-simulation of adsorption and diffusion of hydrocarbons in zeolites) | ||||
| Randall Q. Snurr | post-doc | 2006-2008 | Northwestern | |
Children
Sign in to add trainee| Salvador Rodríguez-Gómez Balestra | grad student | Amsterdam (Physics Tree) | |
| Sebastián Caro Ortiz | grad student | Amsterdam |
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Publications
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| Sharma S, Baur R, Rigutto M, et al. (2024) Computing Entropy for Long-Chain Alkanes Using Linear Regression: Application to Hydroisomerization. Entropy (Basel, Switzerland). 26 |
| Li Z, Shi K, Dubbeldam D, et al. (2024) Efficient Implementation of Monte Carlo Algorithms on Graphical Processing Units for Simulation of Adsorption in Porous Materials. Journal of Chemical Theory and Computation |
| Sharma S, Sleijfer JJ, Op de Beek J, et al. (2024) Prediction of Thermochemical Properties of Long-Chain Alkanes Using Linear Regression: Application to Hydroisomerization. The Journal of Physical Chemistry. B |
| Sharma S, Rigutto MS, Zuidema E, et al. (2024) Understanding shape selectivity effects of hydroisomerization using a reaction equilibrium model. The Journal of Chemical Physics. 160 |
| Rahbari A, Hartkamp R, Moultos OA, et al. (2022) Electro-osmotic Drag and Thermodynamic Properties of Water in Hydrated Nafion Membranes from Molecular Dynamics. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 126: 8121-8133 |
| Sławek A, Jajko G, Ogorzały K, et al. (2022) The Influence of UiO-66 Metal-Organic Framework Structural Defects on Adsorption and Separation of Hexane Isomers. Chemistry (Weinheim An Der Bergstrasse, Germany). e202200030 |
| Polat HM, Salehi HS, Hens R, et al. (2021) New Features of the Open Source Monte Carlo Software Brick-CFCMC: Thermodynamic Integration and Hybrid Trial Moves. Journal of Chemical Information and Modeling |
| Rahbari A, Garcia-Navarro JC, Ramdin M, et al. (2021) Effect of Water Content on Thermodynamic Properties of Compressed Hydrogen. Journal of Chemical and Engineering Data. 66: 2071-2087 |
| Caro-Ortiz S, Zuidema E, Rigutto M, et al. (2021) Competitive Adsorption of Xylenes at Chemical Equilibrium in Zeolites. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 125: 4155-4174 |
| Tanase-Grecea S, Gheorghe A, Dubbeldam D, et al. (2020) Synthesis of chiral MOF-74 frameworks by post-synthetic modification using an amino acid. Chemistry (Weinheim An Der Bergstrasse, Germany) |