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Synthesis of Monodisperse Submicron Spherical Poly(methylmethacrylate) Particles and the Molecular Dynamics Simulation

机译:单分散亚微米球形聚甲基丙烯酸甲酯颗粒的合成及分子动力学模拟

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摘要

The molecular-dynamics method has been used to determine the conformational states of poly(methyl methacrylate) chains in a medium composed of water and a monomer (methyl methacrylate). Experimentally detected spherical particles resulting from polymerization have been found to take the form of droplet-type aggregates containing several chains, with the water and monomer concentrations in the aggregates differing from those in the dispersion medium. It has been shown that the methyl methacrylate concentration in an initial reaction mixture of about 20% is optimal for the formation of spherical droplet-type aggregates. It has been experimentally established that spherical poly(methyl methacrylate) particles with a narrow size distribution are formed at a methyl-methacrylate concentration of ≈23%.
机译:分子动力学方法已用于确定由水和单体(甲基丙烯酸甲酯)组成的介质中聚(甲基丙烯酸甲酯)链的构象状态。实验发现,由聚合反应产生的球形颗粒呈液滴状的聚集体形式,包含多条链,聚集体中的水和单体浓度与分散介质中的不同。已经表明,在初始反应混合物中约20%的甲基丙烯酸甲酯浓度对于形成球形液滴型聚集体是最佳的。实验已经确定,在≈23%的甲基丙烯酸甲酯浓度下,会形成尺寸分布较窄的球形聚(甲基丙烯酸甲酯)颗粒。

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