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  • 非理想超支化反应动力学:链刚性和反应可逆性的影响
  • 来源:何学浩教授个人网站 2012-06-05
  • To deeply understand the dependence of hyperbranched
    polymerization on the specialties of molecular
    chain and chemical reaction, the reaction kinetics of nonideal
    hyperbranched polymerizations considering the chain rigidity
    and reaction reversibility are studied using the reactive threedimensional
    bond fluctuation lattice model. It is found that,
    with the increase of chain rigidity, the formation probability
    of intramolecular rings decreases and less intramolecular
    rings with larger size are formed. It results in the increase of
    the degrees of polymerization and polydispersity index with
    the rise of chain rigidity at higher conversion. Furthermore,
    our simulation shows that the reversibility of reaction has
    strong influences on the equilibrium state and kinetic process
    of hyperbranched polymerizations. When the ratio of reverse
    reaction probability to forward reaction probability is larger,
    the conversion and degrees of polymerization quickly grow
    to the equilibrium value simultaneously. At smaller reverse
    reaction probability, however, the weigh-average degree of
    polymerization and polydispersity index further increase
    slowly after approaching the equilibrium conversion. Our
    results are well-consistent with the experiments to indicate
    that the introduction of the specialties of macromolecule and
    chemical reaction are necessary for quantitative analysis of
    the realistic hyperbranched polymerizations.

  • [来源:中国聚合物网]
  • 了解更多请进入: 何学浩教授个人网站
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