Grand canonical Monte Carlo and molecular dynamics simulations of the structural properties, diffusion and adsorption of hydrogen molecules through poly(benzimidazoles)/nanoparticle oxides composites
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DOI: 10.1016/j.ijhydene.2017.12.122
Abstract: Abstract Comprehensive structural/molecular simulations have been undertaken to study the poly(benzimidazoles) (PBI) membrane combined with four different nano-oxide materials (ZnO, Al2O3, SiO2 and TiO2) for purification and production of hydrogen from natural gases. Composite membranes… read more here.
Keywords: poly benzimidazoles; structural properties; hydrogen; oxides composites ... See more keywords