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Role of Pt Loading in the Photocatalytic Chemistry of Methanol on Rutile TiO2(110) 期刊论文
ACS CATALYSIS, 2019, 卷号: 9, 期号: 1, 页码: 286-294
Authors:  Hao, Qunqing;  Wang, Zhiqiang;  Wang, Tianjun;  Ren, Zefeng;  Zhou, Chuanyao;  Yang, Xueming
Favorite  |  View/Download:5/0  |  Submit date:2019/06/20
Pt cocatalyst  titanium dioxide  hydrogen production  charge separation  methanol to methoxy conversion  
Deuterium Kinetic Isotope Effect in the Photocatalyzed Dissociation of Methanol on TiO2(110) 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2018, 卷号: 122, 期号: 46, 页码: 26512-26518
Authors:  Wang, Tianjun;  Hao, Qunqing;  Wang, Zhiqiang;  Mao, Xinchun;  Ma, Zhibo;  Ren, Zefeng;  Dai, Dongxu;  Zhou, Chuanyao;  Yang, Xueming
Favorite  |  View/Download:4/0  |  Submit date:2019/06/20
Modeling the temperature-dependent peptide vibrational spectra based on implicit-solvent model and enhance sampling technique 期刊论文
CHINESE PHYSICS B, 2016, 卷号: 25, 期号: 1
Authors:  Wu, Tianmin;  Wang, Tianjun;  Chen, Xian;  Fang, Bin;  Zhang, Ruiting;  Zhuang, Wei
Favorite  |  View/Download:2/0  |  Submit date:2019/06/20
Peptide  Two-dimensional Infrared Spectra (2dir)  Folding Landscape  Implicit Solvent Model  
Modeling Ester Carbonyl Stretching FTIR in Water and DMSO based on MD simulation and an ab initio Map 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2015, 卷号: 119, 期号: 0, 页码: 12390
Authors:  Fang B(方彬);  Wang TJ(王天骏);  Chen X(陈娴);  Jin T(金坦);  Zhang RT(张睿挺);  Zhuang W(庄巍)
Favorite  |  View/Download:21/0  |  Submit date:2016/11/24
Modeling Vibrational Spectra of Ester Carbonyl Stretch in Water and DMSO Based on Molecular Dynamics Simulation 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2015, 卷号: 119, 期号: 38, 页码: 12390-12396
Authors:  Fang, Bin;  Wang, Tianjun;  Chen, Xian;  Jin, Tan;  Zhang, Ruiting;  Zhuang, Wei
Favorite  |  View/Download:27/0  |  Submit date:2015/11/17
Simulating ion clustering in potassium thiocyanate aqueous solutions with various ion-water models 期刊论文
Science China-Chemistry, 2014, 卷号: 57, 期号: 12, 页码: 1723
Authors:  Wang TJ(王天骏);  Zhang RT(张睿挺);  Wu TM(吴天敏);  Li HH(李欢欢);  Zhuang W(庄巍)
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Simulating ion clustering in potassium thiocyanate aqueous solutions with various ion-water models 期刊论文
SCIENCE CHINA-CHEMISTRY, 2014, 卷号: 57, 期号: 12, 页码: 1723-1730
Authors:  Wang TianJun;  Zhang RuiTing;  Wu TianMin;  Li HuanHuan;  Zhuang Wei
Favorite  |  View/Download:23/0  |  Submit date:2015/11/17
Ion Clustering  Potassium Thiocyanate  Ion-water Models