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- On the basis of the Intrinsic Reaction Coordinate (IRC) and IRC information computed by the ab initio method at QCISD/6 - 311g* * level, the flux integrals for collinear system and thermal system of the title reaction were calculated, respectively. 采用量子化学从头算方法在QCISD/6-311G水平上计算了该反应的内禀反应坐标(IRC)和IRC上各构型点的振动分析;利用各构型点的信息;计算得到了共线型模型反应和真实热反应沿反应坐标不同能量下的微正则反应通量.
- Could I ask for your reaction to this policy? 我能问一下您对这个政策的反应吗？
- Keywords Trichloroethylene;Perchloroethylene;Hydroxyl radical;Addition reaction;Intrinsic reaction coordinate.; 三氯乙烯;四氯乙烯;羟基自由基;加成反应;内禀反应坐标;
- Keywords Intrinsic reaction coordinate（IRC）;Reaction rate constant;Product vibrational state distribution; 内禀反应坐标（IRC）;反应速率常数;产物振动态分布;
- A reactor is a container for chemical reaction. 反应器是进行化学反应的容器。
- Keywords thermolysis;diacetamide and acetylthioacetamide;intrinsic reaction coordinate（IRC）;MINDO/3 method; 热分解;二乙酰亚胺和硫代乙酰基乙酰胺;内禀反应坐标;MINDO/3方法;
- I'm displeased at your reaction. 我对你的反应很不满意。
- The forces of reaction made reform difficult. 反动势力给改革造成了困难。
- His reaction on this matter is unexpected. 没料到，他对这件事的反应是这样的。
- Keywords Silicon silyl borene （H3Si-B） Intrinsic reaction coordinate （IRC） EIectronic densityTopological analysis Local-concerted reaction; 硅甲基础烯;硅硼杂烯;反应途径;结构过渡态;电子密度;拓扑分析;局部协同反应;
- A sharp reaction; a repercussion. 强烈反应后果，影响
- Their reaction was one of qualified praise. 他们的反应是一种有保留的称赞。
- Existing as an essential constituent or characteristic; intrinsic. 固有的作为一种基本成份或典型特征而存在的; 内在的
- His initial reaction was one of shock. 他最初的反应是震惊。
- The reaction of the audience was instantaneous. 观众即刻有了反应。
- What was his reaction to the plan? 他对这个计划有什么反应?
- The medicine produced a violent reaction. 这药物引起了剧烈的反应。
- My reaction will be to partake in the speech competition. 我的看法倒是要参加这次演说比赛。
- The intrinsic value of a coin is the value of the metal it is made of. 一枚钱币的内在价值是造这枚钱币的金属的价值。
- What was his reaction to the news? 他对这消息的反应如何？
