井新利

我的新闻

中文主页

PR molecular simulation paper will be published on RSC Advances

发布时间:2016-05-27
点击次数:
发布时间:
2016-05-27
文章标题:
PR molecular simulation paper will be published on RSC Advances
内容:

      Yesterday, one paper titled as ‘Thermal stability of phenolic resin: new insights based on bond dissociation energy and reactivity of functional groups’ was accepted by RSC Advances. Cheng Bian, the doctoral candidate of RGFP, is the first author. In this work, DFT approach was adopted to calculate the bond dissociation energies of C-C bonds in methylene bridges and C-O bonds in hydroxyls in the cured phenolic resins (PRs). The radical reactivity of the phenolic rings, methylenes and hydroxyls during the initial pyrolysis were also analyzed. These results are beneficial to understanding the thermal stability of phenolic resin. 

 

 

 

 RGFP关于酚醛树脂固化结构热稳定性的论文即将刊登于RSC Advances
  日前, RGFP 博士研究生边城同学的论文被 RSC 旗下的 RSC Advances 接受,论文的题目为 Thermal stability of phenolic resin: new insights based on bond dissociation energy and reactivity of functional groups 。该工作采用 DFT 计算了酚醛树脂固化结构中亚甲基桥中的 C-C 键和酚羟基中的 C-O 键的键解离能,分析了酚醛树脂在高温裂解时其中的酚环、亚甲基和酚羟基参与自由基反应时的反应活性,从而可以更加深刻地理解酚醛树脂热稳定性。(边城  供稿)