【摘要】 本文应用计算机研究四氢萘裂解反应机理,计算结果表明文中所提出的反应机理不仅从定性,而且从定量上与实验结果比较符合.本文应用灵敏度分析不仅得到最合适的机理步骤,同时还得到一些实验中或计算中难于准确得到的动力学参数.更多还原

【Abstract】 The mechanism of thermolysis of tetralin was studied by computation. The results show that the experiments could be explained quantitatively by the mechanism suggested in this paper. The sensitivity analysis of the reaction mechanism was also used. Some kinetic parameters which were difficult to be determined by experiment precisely were obtained.更多还原