Items where Author is "Vlugt , T. J. H. "

Article

García-Pérez, E. ; Torréns, I. M. ; Lago, S. ; Dubbeldam, D. ; Vlugt, T. J. H. ; Maesen, T. L. M. ; Smit, B. ; Krishna, R. ; Calero, S. (2005) Elucidating alkane adsorption in sodium-exchanged zeolites from molecular simulations to empirical equations Applied Surface Science, 252 (3). pp. 716-722. ISSN 0169-4332

Dubbeldam, D. ; Calero, S. ; Vlugt, T. J. H. ; Krishna, R. ; Maesen, T. L. M. ; Smit, B. (2004) United atom forcefield for alkanes in nanoporous materials The Journal of Physical Chemistry B, 108 (33). pp. 12301-12313. ISSN 1089-5647

Dubbeldam, D. ; Calero, S. ; Vlugt, T. J. H. ; Krishna, R. ; Maesen, T. L. M. ; Beerdsen, E. ; Smit, B. (2004) Force field parameterization through fitting on inflection points in isotherms Physical Review Letters, 93 (8). 088302_1-088302_4. ISSN 0031-9007

Schenk, M. ; Vidal, S. L. ; Vlugt, T. J. H. ; Smit, B. ; Krishna, R. (2001) Separation of alkane isomers by exploiting entropy effects during adsorption on silicalite-1: a configurational-bias monte carlo simulation study Langmuir, 17 (5). pp. 1558-1570. ISSN 0743-7463

Krishna, R. ; Vlugt, T. J. H. ; Smit, B. (1999) Influence of isotherm inflection on diffusion in silicalite Chemical Engineering Science, 54 (12). pp. 1751-1757. ISSN 0009-2509

Vlugt, T. J. H. ; Krishna, R. ; Smit, B. (1999) Molecular simulations of adsorption isotherms for linear and branched alkanes and their mixtures in silicalite The Journal of Physical Chemistry B, 103 (7). pp. 1102-1118. ISSN 1089-5647

Vlugt , T. J. H. ; Smit, B. ; Krishna, R. (1999) Adsorption of linear and branched alkanes in Ferrierite: a computational study Proceedings of the 12th International Zeolite Conference, 1 . pp. 325-332.

Krishna, R. ; Smit, B. ; Vlugt, T. J. H. (1998) Sorption-induced diffusion-selective separation of hydrocarbon isomers using silicalite The Journal of Physical Chemistry A, 102 (40). pp. 7727-7730. ISSN 1089-5639

Vlugt, T. J. H. ; Zhu, W. ; Kapteijn, F. ; Moulijn, J. A. ; Smit, B. ; Krishna, R. (1998) Adsorption of linear and branched alkanes in the zeolite silicalite-1 Journal of the American Chemical Society, 120 (22). pp. 5599-5600. ISSN 0002-7863

Vlugt, T. J. H. ; Martin, M. G. ; Smit, B. ; Siepmann, J. I. ; Krishna, R. (1998) Improving the efficiency of the configurational-bias Monte Carlo algorithm Molecular Physics, 94 (4). pp. 727-733. ISSN 0026-8976