A novel efficient hybrid algorithm for Monte Carlo simulation of controlled radical polymerization: The method integrating reactive and deactivated species

Chemical Engineering Journal(2019)

Cited 9|Views9
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Abstract
•Method speeds up stochastic modeling of processes with fast equilibration reactions.•Stochastic modeling of controlled radical (co)polymerization omits activation.•Simulation time up to hundreds times shorter than using other algorithms.•Method can be applied for obtaining complete information about chain structures.
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Key words
Living/controlled radical copolymerization,Monte Carlo algorithm,Modeling,Kinetics,Microstructure,Chain lengths distribution
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