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Nonadiabatic dynamics study of bridged-azobenzene by the time-dependent density functional tight-binding method 期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2013, 卷号: 1023, 页码: 10-18
Authors:  Fan, Guohong;  Liu, Jianyong;  He, Guozhong;  Liu JY(刘建勇)
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Nonadiabatic Dynamics  Photo-isomerization  Zhu-nakamura Theory  Bridged-azobenzene  Time-dependent Density Functional Tight-binding Method  
White Light Assisted Photosensitized Synthesis of Ag Nanoparticles: Excited-State Hydrogen Bonding Roles 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2013, 卷号: 117, 期号: 22, 页码: 11858-11865
Authors:  Yang, Yang;  Liu, Lei;  Yin, Hongming;  Xu, Dali;  Liu, Guangye;  Song, Xiancheng;  Liu, Jianyong;  Yin HM(尹鸿鸣);  Liu JY(刘建勇)
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Theoretical studies of ground and excited electronic states in a series of heteroleptic iridium complexes using density functional theory 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2012, 卷号: 112, 期号: 11, 页码: 2422-2428
Authors:  Su, Yan;  Kang, Li-Hua;  Su Y(苏艳)
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Absorption Spectrum  Emission Properties  Charge Transfer  Density Functional Calculations  
Hybrid functionals studies of structural and electronic properties of ZnxCd(1Lx)S and (ZnxCd1Lx)(SexS1Lx) solid solution photocatalysts 期刊论文
International Journal of Hydrogen Energy, 2012, 卷号: 37, 页码: 17870
Authors:  Huang JD(黄金斗);  Liu JY(刘建勇);  Han KL(韩克利)
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Promoting Effect of Electrostatic Interaction between a Cobalt Catalyst and a Xanthene Dye on Visible-Light-Driven Electron Transfer and Hydrogen Production 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2011, 卷号: 115, 期号: 30, 页码: 15089-15096
Authors:  Dong, Jingfeng;  Wang, Mei;  Zhang, Pan;  Yang, Songqiu;  Liu, Jianyong;  Li, Xueqiang;  Sun, Licheng;  LichengSun
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