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Theoretical Studies on the Structure and Spectrum of Imidazole-Chloranil Charge Transfer Complex |
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| Authors: | Hai-long Wang Tong-tong Lu Tian-jing He and Dong-ming Chen |
| Institution: | Department of Chemical Physics, University of Science and Technology of China, Hefei 230026, China;Department of Chemical Physics, University of Science and Technology of China, Hefei 230026, China;Department of Chemical Physics, University of Science and Technology of China, Hefei 230026, China;Department of Chemical Physics, University of Science and Technology of China, Hefei 230026, China |
| Abstract: | |
| Keywords: | Charge-transfer complex Density functional theory MP2 Imidazole-chloranil |
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