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- W1990377543 abstract "Abstract An overview is presented of computer simulations applied to zeolite catalysis research. It is shown that using (numerical) statistical methods one is able to explain features observed in Ni2+ ion exchange. Lattice energy minimisation calculations confirm the validity of the model used. Furthermore, Monte Carlo and molecular dynamics simulations offer opportunities to describe adsorption and mass transport phenomena at a molecular level which is of importance in studies on shape selective catalysis." @default.
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- W1990377543 date "1989-10-01" @default.
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- W1990377543 title "Computer Simulations in Zeolite Catalysis Research" @default.
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- W1990377543 doi "https://doi.org/10.1080/08927028908021969" @default.
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