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• W2068797532 abstract "We have used Monte Carlo methods and analytical techniques to investigate the influence of the characteristic parameters, such as pipe length, diffusion, adsorption, desorption, and reaction rate constants on the steady-state properties of single-file systems with a reaction. We looked at cases when all the sites are reactive and when only some of them are reactive. Comparisons between mean-field predictions and Monte Carlo simulations for the occupancy profiles and reactivity are made. Substantial differences between mean-field and the simulations are found when rates of diffusion are high. Mean-field results only include single-file behavior by changing the diffusion rate constant, but it effectively allows passing of particles. Reactivity converges to a limit value if more reactive sites are added: sites in the middle of the system have little or no effect on the kinetics. Occupancy profiles show approximately exponential behavior from the ends to the middle of the system." @default.
• W2068797532 created "2016-06-24" @default.
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• W2068797532 date "2002-06-13" @default.
• W2068797532 modified "2023-10-18" @default.
• W2068797532 title "Steady-state properties of single-file systems with conversion" @default.
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• W2068797532 doi "https://doi.org/10.1103/physreve.65.066701" @default.
• W2068797532 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/12188862" @default.
• W2068797532 hasPublicationYear "2002" @default.
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