HCN与HNC异构化反应活化能的量化计算实验
Quantum Chemistry Calculation Experiment on Activation Energy for Isomerization of HCN and HNC
HCN与HNC异构化反应活化能的量化计算实验 |
| 许秀芳 |
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Quantum Chemistry Calculation Experiment on Activation Energy for Isomerization of HCN and HNC |
| Xiufang Xu |
| 图2 B3LYP/6-311+G(d, p)方法计算所得到的内禀反应坐标(IRC) |
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