《定性化学》提出化学反应速率理论、沉淀理论、金属活泼性理论等重要化学原理；
Important chemical principles such as chemical reaction rate, deposition, chemical activity of metals were pointed in this textbook.
此结果支持了基于绝对反应速率理论的光纤断裂模型，并预测了裂纹扩张速率与外部应力强度的关系。
This result supports previous fracture models that are based on absolute reaction rate theory and predicts an exponential dependence of crack extension rate on applied stress intensity.
然后采用传统过渡态理论计算了在300 ~ 2100k温度范围内的反应速率常数。
The rate constants within the temperature range from 300-2100k are calculated using conventional transition state theory.
利用经典过渡态理论，考虑量子化矫正，计算了反应的速率常数。
Considering the quantum correction, the reaction rate constants were calculated using classical transition state theory.
本文提出了预测核反应堆压力容器钢中杂质元素(主要是磷)晶间非平衡偏析的溶质拖拽模型，并且与速率理论模型进行了对比。
In this paper, a solute drag model was proposed to predict the phosphorus inter granular segregation in reactor pressure vessel steels and compared with the rate theory model.
在此基础上，计算了控制步骤的反应途径，沿反应途径的动态学性质和正则变分过渡态理论的速率常数。
On this basis, the reaction path, the dynamical properties along the reaction path and CVT (canonical variational theory) rate constants of the controlling step were investigated.
在理论上描述了静态破裂剂水化过程中体积增长率与水化反应速率成正比、与体系孔隙率成反比的关系式。
The volume growth rate in proportion with hydration reaction rate and in contrast to void ratio in hydration course was described.
用传统过渡态理论和变分过渡态理论及相关的隧道效应校正计算了反应的速率常数。
The theoretical rate constants in the conventional transition state theory and the variational transition state theory with correction of tunneling effect were calculated.
根据传统过渡态理论、变分过渡态理论及相应的隧道效应校正，计算了本重排反应的反应速率常数。
The reaction rate constants have been calculated according to conventional transition state theory, variational transition state theory and tunneling corrections respectively.
这种理论已应用于许多氢提取反应，在复杂反应的基本动力学模型设计中预测热力学速率常数将是非常有用的。
The new theory was applied to a number of hydrogen abstraction reactions. Excellent agreement with, experimental data shows that the RC-TST method can be very useful in design of fundament…
这种理论已应用于许多氢提取反应，在复杂反应的基本动力学模型设计中预测热力学速率常数将是非常有用的。
The new theory was applied to a number of hydrogen abstraction reactions. Excellent agreement with, experimental data shows that the RC-TST method can be very useful in design of fundament…
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