2005

Molecular understanding of diffusion in confinement

E. Beerdsen, D. Dubbeldam, and B. Smit, Molecular understanding of diffusion in confinement Phys. Rev. Lett. 95, 164505 (2005) http://dx.doi.org/10.1103/PhysRevLett.95.164505

Molecular simulation of loading-dependent diffusion in nanoporous materials using extended dynamically corrected transition state theory

D. Dubbeldam, E. Beerdsen, T. J. H. Vlugt, and B. Smit, Molecular simulation of loading-dependent diffusion in nanoporous materials using extended dynamically corrected transition state theory J. Chem. Phys. 122 (22), 224712 (2005) http://dx.doi.org/10.1063/1.1924548

Molecular path control in zeolite membranes

D. Dubbeldam, S. Calero, E. Beerdsen, and B. Smit, Molecular path control in zeolite membranes Proc. Natl. Acad. Sci. USA 102 (35), 12317 (2005) http://dx.doi.org/10.1073/pnas.0503908102

Elucidating alkane adsorption in sodium-exchanged zeolites from molecular simulations to empirical equations

E. Garcýa-Perez, I. M. Torrens, S. Lago, D. Dubbeldam, T. J. H. Vlugt, T. L. M. Maesen, B. Smit, R. Krishna, and S. Calero, Elucidating alkane adsorption in sodium-exchanged zeolites from molecular simulations to empirical equations App. Surf. Scie. 252 (7), 716 (2005) http://dx.doi.org/10.1016/j.apsusc.2005.02.103

Understanding the loading dependence of self-diffusion in carbon nanotubes

S. Jakobtorweihen, M. G. Verbeek, C. P. Lowe, F. J. Keil, and B. Smit, Understanding the loading dependence of self-diffusion in carbon nanotubes Phys. Rev. Lett 95 (4), 044501 (2005) http://dx.doi.org/10.1103/PhysRevLett.95.044501

Adsorption and separation of linear and branched alkanes on carbon nanotube bundles from configurational-bias Monte Carlo simulation

J. W. Jiang, S. I. Sandler, M. Schenk, and B. Smit, Adsorption and separation of linear and branched alkanes on carbon nanotube bundles from configurational-bias Monte Carlo simulation Phys. Rev. B 72 (4) (2005) http://dx.doi.org/10.1103/PhysRevB.72.045447

Phase Behavior of Model Lipid Bilayers

M. Kranenburg and B. Smit, Phase Behavior of Model Lipid Bilayers J. Phys. Chem. B 109, 6553 (2005) http://dx.doi.org/10.1021/jp0457646

Molecular simulations of the adsorption of cycloalkanes in MFI-type silica

M. Schenk, B. Smit, T. L. M. Maesen, and T. J. H. Vlugt, Molecular simulations of the adsorption of cycloalkanes in MFI-type silica Phys. Chem. Chem. Phys. 7 (13), 2622 (2005) http://dx.doi.org/10.1039/b504006j

Simulation Studies of Protein-Induced Bilayer Deformations, and Lipid-Induced Protein Tilting, on a Mesoscopic Model for Lipid Bilayers with Embedded Proteins

M. Venturoli, B. Smit, and M. M. Sperotto, Simulation Studies of Protein-Induced Bilayer Deformations, and Lipid-Induced Protein Tilting, on a Mesoscopic Model for Lipid Bilayers with Embedded Proteins. Biophys. J. 88, 1778 (2005) http://dx.doi.org/10.1529/biophysj.104.050849


© Berend Smit 2019