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The Influence of Sodium Iodide Salt on the Interfacial Properties of Aqueous Methanol Solution by a Combined Molecular Simulation and Sum Frequency Generation Vibrational Spectroscopy Study 期刊论文
LANGMUIR, 2019, 卷号: 35, 期号: 21, 页码: 7050-7059
Authors:  Liu, Jianchuan;  Li, Xia;  Hou, Jian;  Li, Xun;  Lu, Zhou
Favorite  |  View/Download:2/0  |  Submit date:2019/07/26
Design, synthesis and evaluation of a series of alkylsiloxane-bonded stationary phases for expanded supercritical fluid chromatography separations 期刊论文
JOURNAL OF CHROMATOGRAPHY A, 2019, 卷号: 1593, 页码: 127-134
Authors:  Fu, Qing;  Jiang, Dasen;  Xin, Huaxia;  Dai, Zhuoshun;  Cai, Jianfeng;  Ke, Yanxiong;  Jin, Yu;  Liang, Xinmiao
Favorite  |  View/Download:8/0  |  Submit date:2019/06/20
Supercritical fluid chromatography  Alkylsiloxane-bonded stationary phases  Linear solvation energy relationship  Selectivity  Retention mechanism  
Structures and Infrared Spectra of [M(CO2)(7)](+) (M = V, Cr, and Mn) Complexes 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2019, 卷号: 123, 期号: 17, 页码: 3703-3708
Authors:  Yang, Dong;  Kong, Xiangtao;  Zheng, Huijun;  Su, Mingzhi;  Zhao, Zhi;  Xie, Hua;  Fan, Hongjun;  Zhang, Weiqing;  Jiang, Ling
Favorite  |  View/Download:4/0  |  Submit date:2019/06/20
Size-Dependent Formation of an Ion Pair in HSO4-(H2O)(n): A Molecular Model for Probing the Microsolvation of Acid Dissociation 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2019, 卷号: 10, 期号: 9, 页码: 2162-2169
Authors:  Li, Huiyan;  Kong, Xiangtao;  Jiang, Ling;  Liu, Zhi-Feng
Favorite  |  View/Download:4/0  |  Submit date:2019/06/20
A theoretical investigation on the structures of (NH3)center dot(H2SO4)center dot(H2O)(0-14) clusters 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2019, 卷号: 119, 期号: 7, 页码: 21
Authors:  Xu, Zhen-Zhen;  Fan, Hong-Jun
Favorite  |  View/Download:1/0  |  Submit date:2019/06/20
binding enthalpy  conformational search  hydrogen bond  proton transfer  ternary cluster  
Infrared Photodissociation Spectroscopic and Theoretical Study of [Co(CO2)(n)](+) Clusters 期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2019, 卷号: 32, 期号: 2, 页码: 223-228
Authors:  Yang, Dong;  Su, Ming-zhi;  Zheng, Hui-jun;  Zhao, Zhi;  Li, Gang;  Kong, Xiang-tao;  Xie, Hua;  Fan, Hong-jun;  Zhang, Wei-qing;  Jiang, Ling
Favorite  |  View/Download:9/0  |  Submit date:2019/06/25
Cationic cobalt  Carbon dioxide  Structure  Infrared photodissociation spectroscopy  Quantum chemical calculation  
Infrared spectra of neutral dimethylamine clusters: An infrared-vacuum ultraviolet spectroscopic and anharmonic vibrational calculation study 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2019, 卷号: 150, 期号: 6, 页码: 9
Authors:  Zhang, Bingbing;  Huang, Qian-Rui;  Jiang, Shukang;  Chen, Li-Wei;  Hsu, Po-Jen;  Wang, Chong;  Hao, Ce;  Kong, Xiangtao;  Dai, Dongxu;  Yang, Xueming;  Kuo, Jer-Lai;  Jiang, Ling
Favorite  |  View/Download:10/0  |  Submit date:2019/06/20
How Does the O-6-Methylation Regulate the Excited-State Decay of Guanine Monomers 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2019, 卷号: 123, 期号: 1, 页码: 201-206
Authors:  Zhou, Panwang;  Zhao, Li
Favorite  |  View/Download:6/0  |  Submit date:2019/06/20
A detailed theoretical study on the excited-state hydrogen-bonding dynamics and the proton transfer mechanism for a novel white-light fluorophore 期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2019, 卷号: 66, 期号: 1, 页码: 56-61
Authors:  Gao, Haiyan;  Yang, Guang;  Jia, Min;  Song, Xiaoyan;  Zhang, Qiaoli;  Yang, Dapeng
Favorite  |  View/Download:4/0  |  Submit date:2019/06/20
frontier molecular orbital  infrared spectra  intramolecular hydrogen bond  potential energy curves  proton transfer  
A theoretical study on the excited-state intramolecular proton transfer mechanism of 4-dimethylaminoflavonol chemosensor 期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2019, 卷号: 66, 期号: 1, 页码: 49-55
Authors:  Lv, Jian;  Yang, Guang;  Jia, Min;  Zhao, Jinfeng;  Song, Xiaoyan;  Zhang, Qiaoli
Favorite  |  View/Download:3/0  |  Submit date:2019/06/20
charge transfer  ESIPT  intramolecular hydrogen bond  potential energy curves