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Facile Access to Twisted Intramolecular Charge-Transfer Fluorogens Bearing Highly Pretwisted Donor-Acceptor Systems Together with Readily Fine-Tuned Charge-Transfer Characters 期刊论文
SMALL, 2017, 卷号: 13, 期号: 20
Authors:  Luo, Yanju;  Wang, Yan;  Chen, Shiqi;  Wang, Ning;  Qi, Yige;  Zhang, Xiaogen;  Yang, Minghui;  Huang, Yan;  Li, Ming;  Yu, Junsheng;  Luo, Daibing;  Lu, Zhiyun
Favorite  |  View/Download:24/0  |  Submit date:2017/11/24
Isotope shifts and transition frequencies for the S and P states of lithium: Bethe logarithms and second-order relativistic recoil 期刊论文
PHYSICAL REVIEW A, 2017, 卷号: 95, 期号: 3
Authors:  Wang, L. M.;  Li, Chun;  Yan, Z. -C.;  Drake, G. W. F.
Favorite  |  View/Download:24/0  |  Submit date:2017/11/23
Variational calculation of energy levels for metastable states of antiprotonic helium 期刊论文
CHEMICAL PHYSICS LETTERS, 2016, 卷号: 654, 页码: 114-118
Authors:  Hu, Mu-Hong;  Yao, Si-Meng;  Wang, Yi;  Li, Wang;  Gu, Ying-Ying;  Zhong, Zhen-Xiang
Favorite  |  View/Download:60/0  |  Submit date:2016/07/12
Antiprotonic Helium  Metastable States  Varitaional Calculation  Closed-channel Approximation  
Catalytic mechanism of human N-acetylserotonin methyltransferase: a theoretical investigation 期刊论文
MOLECULAR PHYSICS, 2015, 卷号: 113, 期号: 22, 页码: 3438-3449
Authors:  Wang, Li;  Zhang, Ting;  Li, Jieqiong;  He, Chaozheng;  He, Hongqing;  Zhang, Jinglai
Favorite  |  View/Download:85/0  |  Submit date:2015/12/29
Human N-acetylserotonin Methyltransferase  Dft  Deprotonation  S-adenosyl-l-methionine  Methyl-transfer Mechanism  
Mode specific dynamics of the H-2 + CH3 -> H + CH4 reaction studied using quasi-classical trajectory and eight-dimensional quantum dynamics methods 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2015, 卷号: 143, 期号: 15
Authors:  Wang, Yan;  Li, Jun;  Chen, Liuyang;  Lu, Yunpeng;  Yang, Minghui;  Guo, Hua
Favorite  |  View/Download:35/0  |  Submit date:2015/12/17
Mode specific dynamics of the H-2 + CH3 -> H + CH4 reaction studied using quasi-classical trajectory and eight-dimensional quantum dynamics methods 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2015, 卷号: 143, 期号: 15
Authors:  Wang, Yan;  Li, Jun;  Chen, Liuyang;  Lu, Yunpeng;  Yang, Minghui;  Guo, Hua
Favorite  |  View/Download:33/0  |  Submit date:2015/12/17
Catalytic Activity of a Series of Synthesized and Newly Designed Pyridinium-Based Ionic Liquids on the Fixation of Carbon Dioxide: A DFT Investigation 期刊论文
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2015, 卷号: 54, 期号: 33, 页码: 8093-8099
Authors:  Li, Ya;  Wang, Li;  Huang, Tengfei;  Zhang, Jinglai;  He, Hongqing
Favorite  |  View/Download:66/0  |  Submit date:2015/10/09
Insight into the catalytic activity for a series of synthesized and newly designed phosphonium-based ionic liquids on the fixation of carbon dioxide 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2015, 卷号: 134, 期号: 6
Authors:  Wang, Li;  Li, Ping;  Li, Ya;  He, Hongqing;  Zhang, Jinglai
Favorite  |  View/Download:76/0  |  Submit date:2015/07/20
Functionalized Phosphonium-based Ionic Liquids  Co2  Chain Length  Cation  
Tuning the electronic and phosphorescence properties of blue-emitting iridium(III) complexes through different cyclometalated ligand substituents: a theoretical investigation 期刊论文
DALTON TRANSACTIONS, 2015, 卷号: 44, 期号: 18, 页码: 8577-8589
Authors:  Li, Jieqiong;  Zhang, Qing;  He, Hongqing;  Wang, Li;  Zhang, Jinglai
Favorite  |  View/Download:67/0  |  Submit date:2015/07/06
Mechanism of fixation of CO2 with an epoxide catalyzed by ZnBr2 and a choline chloride co-catalyst: a DFT study 期刊论文
RSC ADVANCES, 2015, 卷号: 5, 期号: 67, 页码: 54266-54274
Authors:  Huang, Tengfei;  Fang, Lei;  Li, Ya;  He, Hongqing;  Wang, Li;  Zhang, Jinglai
Favorite  |  View/Download:82/0  |  Submit date:2015/08/18