Monte Carlo simulation of photoinduced atom-transfer radical polymerization for dynamic microscopic properties

Chemical Engineering Science(2023)

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摘要
•Monte Carlo model is created for photoinduced atom-transfer radical polymerization.•The dynamic model offers insights into polymerization kinetics and mechanisms.•The evolution of the microscopic properties of the polymers is predicted.•Light intermittency is incorporated in the dynamic Monte Carlo simulation.•Investigation was conducted to enhance temporal light intermittency performance.
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关键词
Photoinduced polymerization, Atom -transfer radical polymerization, Monte Carlo simulation, Microscopic properties, Molecular weight distribution, Temporal control
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