Publications in collaboration with researchers from University of Amsterdam (10)

2011

  1. External surface adsorption on silicalite-1 zeolite studied by molecular simulation

    Journal of Physical Chemistry C, Vol. 115, Núm. 31, pp. 15355-15360

2007

  1. Understanding aluminum location and non-framework ions effects on alkane adsorption in aluminosilicates: A molecular simulation study

    Journal of Physical Chemistry C, Vol. 111, Núm. 28, pp. 10419-10426

  2. Incorporating the loading dependence of the maxwell-stefan diffusivity in the modeling of CH4 and CO2 permeation across zeolite membranes

    Industrial and Engineering Chemistry Research, Vol. 46, Núm. 10, pp. 2974-2986

  3. A simulation study of alkanes in Linde Type A zeolites

    Adsorption Science and Technology, Vol. 25, Núm. 6, pp. 417-427

  4. A computational study of CO2, N2, and CH4 adsorption in zeolites

    Adsorption, Vol. 13, Núm. 5-6, pp. 469-476

  5. A computational method to characterize framework aluminum in aluminosilicates

    Angewandte Chemie - International Edition, Vol. 46, Núm. 1-2, pp. 276-278

2006

  1. Diffusion of CH4 and CO2 in MFI, CHA and DDR zeolites

    Chemical Physics Letters, Vol. 429, Núm. 1-3, pp. 219-224

  2. A coarse-graining approach for the proton complex in protonated aluminosilicates

    Journal of Physical Chemistry B, Vol. 110, Núm. 12, pp. 5838-5841

2005

  1. Molecular simulation of adsorption of n-alkanes in Na-MFI zeolites. Determination of empirical expressions

    Studies in Surface Science and Catalysis

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

    Applied Surface Science