The transition states of various possible reaction pathways were obtained and verified by internal reaction coordinate (IRC) analysis.
计算得到各可能反应途径的过渡态,并经过内禀反应坐标分析加以证实。
The transition states of various possible reaction pathways are obtained and are verified by internal reaction coordinate (IRC) analyzing.
计算得到各可能反应途径的过渡态,并通过内禀反应坐标(IRC)分析加以证实。
The transition states of the two reaction paths are obtained and verified by the analysis of vibration and internal reaction coordinate (IRC).
通过振动频率和内禀反应坐标(IRC)分析,对反应过渡态进行了确认。
The transition states of the two reaction paths are obtained and verified by the analysis of vibration and internal reaction coordinate (IRC).
通过振动频率和内禀反应坐标(IRC)分析,对反应过渡态进行了确认。
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