4.Results and discussion
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
1.Introduction
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
putational details
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
5.Conclusion
参考文献 Cao X, Rong C, Zhong A, et al. Molecular acidity: An accurate description with information‐theoretic approach in density functional reactivity theory[J]. Journal of Computational Chemistry, 2017. Donghai Yu, Ruobing Du,Ji-Chang Xiao,et al. Theoretical Study of pKa Values for Trivalent Rare-Earth Metal Cations in Aqueous Solution [J].Journal of Phusical Chemistry,2017
近期工作汇报
谢谢观赏
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
4.Results and discussion
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
文献汇报
XXX 2017年 月 日
Hale Waihona Puke Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tian Lu , and Shubin Liu
2.Theoretical framework
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
4.Results and discussion
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
1.Introduction
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
putational details
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu
5.Conclusion
Theoretical Study of pKa Values for Trivalent Rare-Earth Metal Cations in Aqueous Solution
Donghai Yu, Ruobing Du, Ji-Chang Xiao, Shengming Xu, Chunying Rong,and Shubin Liu
2.Theoretical framework
Molecular Acidity: An Accurate Description with InformationTheoretic Approach in Density Functional Reactivity Theory
Xiaofang Cao, Chunying Rong, Aiguo Zhong, Tia Lu , and Shubin Liu