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中文摘要：
根据偶联剂改性无机粒子的作用机理．提出了一个硅烷偶联剂接枝在氧化锌表面的结构模型。用Gaussian03对两种硅烷偶联剂接枝在纳米氧化锌表面的模型进行了理论计算．结果表明，KH550和KH560能与纳米氧化锌表面结合而达到改性的目的．KH560的效果更好．实验与理论计算的结果相吻合．
英文摘要：
Based on the functional mechanism of coupling agents grafted on inorganic particles, a structure of modified on nano-zinc oxide by silane coupling agent grafting was proposed,two silane coupling agents structures were calculated by Gaussian 03 .The calculation indicated that：coupliag agene KH550 and KH560 were effective, KH560 was more suitable, The experiments matched well with calculation.
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