Diffusion of propane, propylene and isobutane in 13X zeolite by molecular dynamics

This paper presents single component diffusion data of propane, propylene and isobutane in zeolite 13X obtained by molecular dynamics (MD) simulations, especially its dependence on temperature and concentration. Our results are critically compared to experiments and previous simulation data, when av...

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Detalhes bibliográficos
Autor principal: Miguel A. Granato (author)
Outros Autores: Miguel Jorge (author), Thijs J.H. Vlugt (author), Alírio E. Rodrigues (author)
Formato: article
Idioma:eng
Publicado em: 2010
Assuntos:
Texto completo:https://repositorio-aberto.up.pt/handle/10216/95631
País:Portugal
Oai:oai:repositorio-aberto.up.pt:10216/95631