1. A multiscale modelling approach to elucidate the mechanism of the oxygen evolution reaction at the hematite–water interface. (18th March 2021) Authors: Sinha, V.; Sun, D.; Meijer, E. J.; Vlugt, T. J. H.; Bieberle-Hütter, A. Journal: Faraday discussions Issue: Volume 229(2021) Page Start: 89 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Adsorption equilibrium of nitrogen dioxide in porous materials. Issue 6 (24th January 2018) Authors: Matito-Martos, I.; Rahbari, A.; Martin-Calvo, A.; Dubbeldam, D.; Vlugt, T. J. H.; Calero, S. Journal: Physical chemistry chemical physics Issue: Volume 20:Issue 6(2018) Page Start: 4189 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Binary and ternary mixtures of liquid crystals with CO2. Issue 9 (September 2015) Authors: de Groen, M.; Vlugt, T. J. H.; de Loos, T. W. Journal: AIChE journal Issue: Volume 61:Issue 9(2015:Sep.) Page Start: 2977 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Computation of partial molar properties using continuous fractional component Monte Carlo. (17th November 2018) Authors: Rahbari, A.; Hens, R.; Nikolaidis, I. K.; Poursaeidesfahani, A.; Ramdin, M.; Economou, I. G.; Moultos, O. A.; Dubbeldam, D.; Vlugt, T. J. H. Journal: Molecular physics Issue: Volume 116:Number 21/22(2018) Page Start: 3331 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Crystals for sustainability – structuring Al-based MOFs for the allocation of heat and cold. Issue 2 (25th July 2014) Authors: de Lange, M. F.; Ottevanger, C. P.; Wiegman, M.; Vlugt, T. J. H.; Gascon, J.; Kapteijn, F. Journal: CrystEngComm Issue: Volume 17:Issue 2(2015) Page Start: 281 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Crystals for sustainability – structuring Al-based MOFs for the allocation of heat and cold. Issue 2 (25th July 2014) Authors: de Lange, M. F.; Ottevanger, C. P.; Wiegman, M.; Vlugt, T. J. H.; Gascon, J.; Kapteijn, F. Journal: CrystEngComm Issue: Volume 17:Issue 2(2015) Page Start: 281 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Effect of truncating electrostatic interactions on predicting thermodynamic properties of water–methanol systems. Issue 4 (24th March 2019) Authors: Rahbari, A.; Hens, R.; Jamali, S. H.; Ramdin, M.; Dubbeldam, D.; Vlugt, T. J. H. Journal: Molecular simulation Issue: Volume 45:Issue 4/5(2019) Page Start: 336 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Finite-size effects of Kirkwood–Buff integrals from molecular simulations. Issue 7 (3rd May 2018) Authors: Dawass, N.; Krüger, P.; Schnell, S. K.; Bedeaux, D.; Kjelstrup, S.; Simon, J. M.; Vlugt, T. J. H. Journal: Molecular simulation Issue: Volume 44:Issue 7(2018) Page Start: 599 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Gibbs ensemble Monte Carlo simulations of multicomponent natural gas mixtures. Issue 5 (24th March 2018) Authors: Ramdin, M.; Jamali, S. H.; Becker, T. M.; Vlugt, T. J. H. Journal: Molecular simulation Issue: Volume 44:Issue 5(2018) Page Start: 377 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Improving the accuracy of computing chemical potentials in CFCMC simulations. (17th December 2019) Authors: Rahbari, A.; Hens, R.; Dubbeldam, D.; Vlugt, T. J. H. Journal: Molecular physics Issue: Volume 117:Number 23/24(2019) Page Start: 3493 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗