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Reconsideration on Hydration of Sodium Ion: From Micro-Hydration to Bulk Hydration 期刊论文
RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 91, 期号: 13, 页码: 2539-2547
作者:  Zhou Yongquan;  Fang Chunhui;  Fang Yan;  Zhu Fayan;  Ge Haiwen;  Liu Hongyan
收藏  |  浏览/下载:91/0  |  提交时间:2018/06/20
Sodium Ion  Dft  Cpmd  Micro Hydration  Rdf  
Microhydration of BH4-: Dihydrogen Bonds, Structure, Stability, and Raman Spectra 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 121, 期号: 47, 页码: 9146-9155
作者:  Zhou, Yongquan;  Yoshida, Koji;  Yamaguchi, Toshio;  Liu, Hongyan;  Fang, Chunhui;  Fang, Yan
收藏  |  浏览/下载:103/0  |  提交时间:2018/06/20
Phase change performance assessment of salt mixtures for thermal energy storage material 期刊论文
INTERNATIONAL JOURNAL OF ENERGY RESEARCH, 2017, 卷号: 41, 期号: 13, 页码: 1855-1866
作者:  Zhu, F. Y.;  Zhou, H. X.;  Zhou, Y. Q.;  Ge, H. W.;  Fang, W. C.;  Fang, Y.;  Fang, C. H.
收藏  |  浏览/下载:113/0  |  提交时间:2018/06/20
Phase Change Material (Pcm)  Nucleating Agent  Supercooling Phenomena  Density Functional Theory  Molten Structure  
The investigation of structure and IR spectra for hydrated potassium ion clusters K+(H2O)(n=1-16) by density functional theory 期刊论文
EUROPEAN PHYSICAL JOURNAL D, 2016, 卷号: 70, 期号: 11
作者:  Zhu, Fayan;  Zhou, Hongxia;  Zhou, Yongquan;  Miao, Juntao;  Fang, Chunhui;  Fang, Yan;  Sun, Pengchao;  Ge, Haiwen;  Liu, Hongyan
收藏  |  浏览/下载:78/0  |  提交时间:2018/06/20
Characterizing Ni(II) hydration in aqueous solution using DFT and EXAFS 期刊论文
JOURNAL OF MOLECULAR MODELING, 2016, 卷号: 22, 期号: 1
作者:  Liu, H. Y.;  Fang, C. H.;  Fang, Y.;  Zhou, Y. Q.;  Ge, H. W.;  Zhu, F. Y.;  Sun, P. C.;  Miao, J. T.
收藏  |  浏览/下载:85/0  |  提交时间:2018/06/20
Nickel Ion  Coordination Number  Hydration Shell  Dft  Exafs  
Structure of aqueous potassium pentaborate solution 期刊论文
JOURNAL OF MOLECULAR STRUCTURE, 2015, 卷号: 1083, 页码: 471-479
作者:  Zhu, F. Y.;  Fang, C. H.;  Fang, Y.;  Zhou, Y. Q.;  Ge, H. W.;  Liu, H. Y.
收藏  |  浏览/下载:65/0  |  提交时间:2018/06/20
Potassium Pentaborate  Solution Structure  X-ray Scattering  Density Function Theory  
Structure of aqueous potassium metaborate solution 期刊论文
JOURNAL OF MOLECULAR STRUCTURE, 2014, 卷号: 1070, 页码: 80-85
作者:  Zhu, F. Y.;  Fang, C. H.;  Fang, Y.;  Zhou, Y. Q.;  Ge, H. W.;  Liu, H. Y.
收藏  |  浏览/下载:62/0  |  提交时间:2018/06/20
Potassium Metaborate  Solution Structure  X-ray Scattering  Raman Spectra  
Polyborates in aqueous borate solution: A Raman and DFT theory investigation 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2011, 卷号: 83, 期号: 1, 页码: 82-87
作者:  Zhou, Yongquan;  Fang, Chunhui;  Fang, Yan;  Zhu, Fayan
Adobe PDF(785Kb)  |  收藏  |  浏览/下载:429/31  |  提交时间:2013/07/02
Polyborate  Raman Spectrum  Aqueous Solution  Density Functional Theory  Characteristic Frequency  Ab Initio