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Oenema, Jogchum (author), Harmel, Justine (author), Vélez, Roxana Pérez (author), Meijerink, Mark J. (author), Eijsvogel, Willem (author), Poursaeidesfahani, A. (author), Vlugt, T.J.H. (author), Zečević, Jovana (author), De Jong, Krijn P. (author)
In this study, Pt nanoparticles on zeolite/γ-Al2O3 composites (50/50 wt) were located either in the zeolite or on the γ-Al2O3 binder, hereby varying the average distance (intimacy) between zeolite acid sites and metal sites from "closest"to "nanoscale". The catalytic performance of these catalysts was compared to physical mixtures of zeolite...
journal article 2020
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Trinh, T.T. (author), Vlugt, T.J.H. (author), Hägg, M.B. (author), Bedeaux, D. (author), Kjelstrup, S.H. (author)
We performed classical molecular dynamics (MD) simulations to understand the mechanism of adsorption from a gas mixture of CO2 and H2 (mole fraction of CO2 = 0.30) and diffusion along a graphite surface, with the aim to help enrich industrial off-gases in CO2, separating out H2. The temperature of the system in the simulation covered typical...
journal article 2013