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Results: 96
Number of items: 96
  • Schenk, M., Smit, B., Maesen, T. L. M., & Vlugt, T. J. H. (2005). Molecular simulations of the adsorption of cycloalkanes in MFI-type silica. Physical Chemistry Chemical Physics, 7(13), 2622-2628. https://doi.org/10.1039/b504006j
  • Dubbeldam, D., Calero, S., Vlugt, T. J. H., Krishna, R., Maesen, T. L. M., Beerdsen, E., & Smit, B. (2004). Force field parametrization through fitting on inflection points in isotherms. Physical Review Letters, 93(8), Article 088302.
  • Calero, S., Dubbeldam, D., Krishna, R., Smit, B., Vlugt, T. J. H., Denayer, J. F. M., Martens, J. A., & Maesen, T. L. M. (2004). Understanding the Role of Sodium during Adsorption: A Force Field for Alkanes in Sodium-Exchanged Faujasites. Journal of the American Chemical Society, 126(36), 11377-11386. https://doi.org/10.1021/ja0476056
  • Dubbeldam, D., Calero, S., Vlugt, T. J. H., Krishna, R., Maesen, T. L. M., & Smit, B. (2004). United Atom Force Field for Alkanes in Nanoporous Materials. The journal of Physical Chemistry. B, 108(33), 12301-12313. https://doi.org/10.1021/jp0376727
  • Combe, N., Vlugt, T. J. H., ten Wolde, P. R., & Frenkel, D. (2003). Dynamic pruned-enriched Rosenbluth method. Molecular Physics, 101(11), 1675-1682. https://doi.org/10.1080/0026897031000094461
  • Schenk, M., Calero Diaz, S., Maesen, T. L. M., Vlugt, T. J. H., van Benthem, L. L., Verbeek, M. G., & Schnell, B. (2003). Shape selectivity through entropy. Journal of Catalysis, 214(1), 1-168. https://doi.org/10.1016/S0021-9517(02)00136-7
  • Open Access
    Beerdsen, E., Dubbeldam, D., Smit, B., Vlugt, T. J. H., & Calero Diaz, S. (2003). Simulating the Effect of Nonframework Cations on the Adsorption of Alkanes in MFI-type Zeolites. The journal of Physical Chemistry. B, 44, 12088-12096.
  • Vlugt, T. J. H., & Schenk, M. (2002). Influence of Framework Flexibility on the Adsorption Properties of Hydrocarbons in the Zeolite Silicalite. The journal of Physical Chemistry. B, 106, 12757-12763. https://doi.org/10.1021/jp0263931
  • Schenk, M., Vidal, S. L., Vlugt, T. J. H., & Krishna, R. (2001). Separation of alkane isomers by exploiting entropy effects during adsorption on silicalite-1: A Configurational-Bias Monte Carlo simulation stud. Langmuir, 17, 1558-1570. https://doi.org/10.1021/la001189v
  • Maesen, T. L. M., Schenk, M., Vlugt, T. J. H., & Smit, B. (2001). Differences between MFI- and MEL-type Zeolites in Paraffin Hydrocracking. Journal of Catalysis, 203, 281-291. https://doi.org/10.1006/jcat.2001.3332
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