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Diffusion of Isobutane in Silicalite studied by Transition Path Sampling

Diffusion of Isobutane in Silicalite studied by Transition Path Sampling [Pg.81]

In this chapter, we will use transition path sampling to study the hopping of the smallest branched alkane, isobutane, in the zeolite Silicalite. In section 6.2, we will briefly summarize [Pg.81]

T. J.H. Vlugt, C. Dellago, and B. Smit (2000) Diffusion of Isobutane in Silicalite studied by Transition Path Sampling. J. Chem. Phys., 113, p. 8791... [Pg.390]

See other pages where Diffusion of Isobutane in Silicalite studied by Transition Path Sampling is mentioned: [Pg.93]

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Diffusion in silicalite

Diffusion of isobutane

Diffusion path

Diffusion sample

Diffusion studies

Diffusive sampling

Diffusivity in silicalite

Diffusivity of isobutane

Diffusivity studies

Isobutane

Isobutanes

Path of

Path sampling

Silicalites

Transition path sampling

Transitional studies