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High activity of amine-doped H-ZSM-5 zeolite in ethene protonation: revealed by embedding calculations. |
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| Authors: | Anmin Zheng Lin Wang Lei Chen Yong Yue Chaohui Ye Xin Lu Feng Deng |
| Institution: | State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics, Wuhan Institute of Physics and Mathematics, The Chinese Academy of Sciences, Wuhan 430071, People's Republic of China. |
| Abstract: | |
| Keywords: | density functional calculations mesoporous materials reaction mechanisms transition states zeolites |