The quantum mechanical foundation of transition-statetheory is studied from the viewpoint of reactive collision theory.
本文从量子反应碰撞理论的观点出发,探讨了过渡态理论的量子力学基础。
2
The rate constants within the temperature range from 300-2100k are calculated using conventional transitionstatetheory.
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。
3
The theoretical rate constants in the conventional transitionstatetheory and the variational transitionstatetheory with correction of tunneling effect were calculated.