湖南师范大学化学化工学院刘述斌

tianjiao

刘述斌
性  别：男
学历：博士
职称：教授
其他：博士生导师，讲座教授
1981年9月至1985年7月， 学士，湖南师范大学化学系
1985年9月至1988年6月， 硕士，兰州大学化学系
1988年7月至1993年12月，湖南师范大学化学系助教、讲师
1994年1月至1996年9月， 博士，美国北卡罗莱纳大学化学系
1996年10月至2000年8月，美国杜克大学化学系、北卡罗莱纳大学化学系、生化系博士后
2000年9月至2005年7月， 美国北卡罗莱纳大学Research Computing Center, Computational Scientist
2005年8月至今，美国北卡罗莱纳大学Research Computing Center,Senior Computational Scientist
2004年8月至今，湖南师范大学化学化工学院讲座教授
研究方向：理论化学、计算化学
研究兴趣：密度泛函理论（Density Functional Theory)和密度泛函活性理论(Density Functional Reactivity Theory)的发展及在生命科学和纳米材料中的应用
Total Citations:1480 (as of May 1, 2010)
Average Citation per Article: 15.91
H-Index:21


个人网页:http://www.unc.edu/~shubin
ReseacherID: http://www.researcherid.com/rid/B-1502-2009
论文网页:http://www.unc.edu/~shubin/papers.html
近年来发表论文：
Effective simulation...        Chem. Phys. Lett. 2007        /UPwork/2007112211628977.pdf
Computation of Large Systems..        J. Comp. Chem. 2007        /UPwork/200721423191718181.pdf
Catalytic Conjugate Addition..        J. Am. Chem. Soc. 2007        /UPwork/200722210385735198.pdf
Necessary & sufficient...        Phys. Rev. A 2007        /UPwork/20072280243297297.pdf
Structural and dynamical ...        J. Phys. Chem. 2007        /UPwork/200741920514313821.pdf
On the relationship...        J. Chem. Phys. 2007        /UPwork/20075297471146038.pdf
Steric effect        J. Chem. Phys. 2007        /UPwork/20076232592774393.pdf
Development, Mechanism, and...        J. Am. Chem. Soc. 2007        /UPwork/200771119492591694.pdf
Atomic correlation energy....        J. Phys. Chem. 2007        /UPwork/200710112017596595.pdf
Binuclear manganese(II) ....        Mol. Phys. 2007        /UPwork/200811522372538132.pdf
Local wave-vector, Shannon...        Phys. Lett. A 2008        http://www.unc.edu/~shubin/PDFs/PLA_2008.pdf
Structure, Spectroscopy,...        J. Phys. Chem. 2008        http://www.unc.edu/~shubin/PDFs/JPCA_2008.pdf
Ethane rotation barrier...        J. Phys. Chem. 2008        http://www.unc.edu/~shubin/PDFs/JPCA_2008_2.pdf
Ru catalysis mechanism...        J. Phys. Chem. 2008        http://www.unc.edu/~shubin/PDFs/JPCC_2008.pdf
Exploring origin....        J. Chem. Phys. 2008        http://www.unc.edu/~shubin/PDFs/JCP_2008.pdf
Impact of Lewis Acids...        J. Phys. Chem. 2008        http://www.unc.edu/~shubin/PDFs/JPCA_2008_3.pdf
Titania Nanotube NMR ...        J. Phys. Chem. 2008        http://www.unc.edu/~shubin/PDFs/JPCC_2008_2.pdf
The role of water in....        J. Theor. Comp. Chem. 2008        http://www.unc.edu/~shubin/PDFs/JTCC_2008.pdf
Electrophilicity        Theory of Chemical Reactivity, 2009        http://www.unc.edu/~shubin/PDFs/electroph.pdf
Crystallization Force ....        Chem. Euro. J. 2009        http://www.unc.edu/~shubin/PDFs/CEJ_2009.pdf
Solar energy conversion ....        J. Phys. Chem. 2009        http://www.unc.edu/~shubin/PDFs/JPCC_2009.pdf
Atomic/Group Steric effect....        J. Phys. Chem. 2009        http://www.unc.edu/~shubin/PDFs/JPCA_2009_1.pdf
概念密度泛函理论及近来的一些进展        Acta Phys. Chim. Sin. 2009        http://www.unc.edu/~shubin/PDFs/APCS_2009.pdf
Estimate pKa values...        J. Phys. Chem. 2009        http://www.unc.edu/~shubin/PDFs/JPCA_2009_2.pdf
Impact of Cyanoethy Groups...        Acta Phys. Chim. Sin. 2009        http://www.unc.edu/~shubin/PDFs/APCS_2009_2.pdf
Ruthenium mechanism....        Organometallics 2009        http://www.unc.edu/~shubin/PDFs/Organomet_2009.pdf
Structure, Reactivity....        Acta Phys. Chim. Sin. 2009        http://www.unc.edu/~shubin/PDFs/APCS_2009_3.pdf
Multiscale approaches ...        Phys Chem Chem Phys 2009        http://www.unc.edu/~shubin/PDFs/PCCP_2009.pdf
Conjugated Polymers ...        Appl. Mat. & Interfaces 2009        http://www.unc.edu/~shubin/PDFs/AMI_2009.pdf
Cyclopolymerization ...        J. Phys. Chem. 2009        http://www.unc.edu/~shubin/PDFs/JPCA_2009_3.pdf
Metal_specificity        J. Phys. Chem. 2009        http://www.unc.edu/~shubin/PDFs/JPCA_2009_4.pdf
Potentialphilicity and potenia        J. Chem. Phys. 2009        http://www.unc.edu/~shubin/PDFs/JCP_2009.pdf
Chargephilicity        Chem. Phys. Lett. 2009        http://www.unc.edu/~shubin/PDFs/CPL_2009.pdf
Molecular Acidity....        J. Chem. Phys. 2009        http://www.unc.edu/~shubin/PDFs/JCP_2009_2.pdf
Organic Crystal....        Phys Rev B 2009        http://www.unc.edu/~shubin/PDFs/PRB_2009.pdf
Solar cell....        Macromolecules 2010        http://www.unc.edu/~shubin/PDFs/Macromol_2010.pdf
Solar cell....        Adv. Funct. Mater. 2010        http://www.unc.edu/~shubin/PDFs/AFM_2010.pdf
Polariable force field....        J. Chem. Theor. Comp. 2010        http://www.unc.edu/~shubin/PDFs/JCTC_2010.pdf
Solar energy...        J. Phys. Chem. 2010        http://www.unc.edu/~shubin/PDFs/JPCC_2010.pdf
Steric effect in SN2 rxs....        J. Phys. Chem. 2010        http://www.unc.edu/~shubin/PDFs/JPCA_2010.pdf
Confused porphyrin....        J. Org Chem. 2010        http://www.unc.edu/~shubin/PDFs/JOC_2010.pdf
Vitamin K Carboxylase...        Int. J. Quantum Chem. 2010        http://www.unc.edu/~shubin/PDFs/IJQC_2010.pdf
Why iron? A SP-CDFT study...        J. Phys. Chem. 2010        http://www.unc.edu/~shubin/PDFs/JPCA_2010_2.pdf
Chiral Heme Complexes...        Acta Phys. Chim. Sin. 2010        http://www.unc.edu/~shubin/PDFs/APCS_2010.pdf
Quantify Steric Effect        J. Chem. Phys. 2010        http://www.unc.edu/~shubin/PDFs/JCP_2010.pdf
已获得的主要成果：
Feb. 2000        Quantum Theory Project (QTP) Stipend Winner        University of Florida
April 2005        2005 Information Technology Awards        University of North Carolina
March 2006        Wiley - IJQC Young Investigator Award        46th Sanibel Symposium
April 2010        2010 Information Technology Awards (Team Award)        University of North Carolina