汕頭大學(xué)化學(xué)系2015年研究生調(diào)劑信息

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汕頭大學(xué)化學(xué)系陳廣慧教授招收“計算機(jī)化學(xué)”碩士生2名

1、研究方向：

a. 小分子藥物設(shè)計

b. 小分子激發(fā)態(tài)光譜

c. 金屬配合物磷光光譜

d. MOF對小分子氣體吸附

e. 大氣化學(xué)。

2. 導(dǎo)師簡介

a.陳廣慧：男，1972年生，博士，教授。1999年進(jìn)入吉林大學(xué)理論化學(xué)計算國家重點實驗室后，開始從事理論化學(xué)計算研究。2002年以來發(fā)表有關(guān)小分子結(jié)構(gòu)與穩(wěn)定性、離子-分子反應(yīng)機(jī)理、配合物光譜和納米管功能化等研究論文30余篇，均被SCI收錄，大多發(fā)表在J. Phys. Chem.、 J. Chem. Phys.等美國著名期刊，在理論化學(xué)計算領(lǐng)域具有一定的影響力。于2005、2007年先后赴美國加州州立大學(xué)和香港大學(xué)訪學(xué)。

b. 受教育經(jīng)歷

•1999－2004     吉林大學(xué)理論化學(xué)計算國家重點實驗室，碩博聯(lián)讀

c. 研究工作經(jīng)歷

•2005-2006,       美國加州州立大學(xué)             訪問學(xué)者

•2007-2008,       香港大學(xué), 理學(xué)院化學(xué)系    高級研究助理

•2008, 6-至今,    汕頭大學(xué)，理學(xué)院化學(xué)系   教 授, 碩導(dǎo)

3、部分發(fā)表論文

1. Ke-fu Gao, Guang-hui Chen*, and Di Wu

A DFT study on the interaction between glycine molecules/radicals and the (8,0)SiCNT”Phys. Chem. Chem. Phys.  2014, 16, 17988-17997. （IF=4.22，第一單位）

2. Bing Zhong1,#, Yunmei Zhen2,#, Guangrong Qin1, Huaiyu Yang1, Hualiang Jiang1,Guanghui Chen2,* and Kunqian Yu1,* Progress in Studies of Structure, Mechanism and Antagonists Interaction of GPCR Co-Receptors for HIV Current Pharmaceutical Biotechnology, 2014, 15, 000-000（IF=2.5，第一單位）

3.Yun-mei Zhen, Guang-rong Qin, Cheng Luo, Hua-liang Jiang, Kun-qian Yun* and Guang-hui Chen*

Exploring ring-catalyzed Ubiquitin transfer mechanism by MD and QM/MM calculations, PloS. One, 2014, 9(7), e101663. （IF=3.534，第一單位）

4.Hui Wu, Guanghui Chen*, Yun-peng Yu and Qiang Wang

Theoretical exploration of the half-metallicity of graphene nanoribbons/boron nitride bilayer system

Comput. Mat. Sci., 2014, 95, 384-392（IF=2.2，第一單位）

5. Hai-long Liang, Guang-hui Chen*, and Feng-long Gu* Theoretical study on the mechanism of reaction of CHF2 with NO2
Comput. Theo. Chem., 2013, 1010, 1-10（IF=1.1，第一單位）

6. Hai-xia Lin, Hai-long Liang, Guang-hui Chen*, Feng-long Gu*,Wen-guang Liu and Shao-fei Ni Theoretical study on the reaction mechanisms of CH3O- with O2(X3g-) and O2(a1Δg) J. Phys. Chem. A, 2012, 116, 11656 – 11667（IF=2.9，第一單位）

7. Da-Qian Feng, Xiao-Ping Zhou, Ji Zheng, Guang-hui Chen, Xiao-Chun Huang and Dan Li*
In situ selective N-alkylation of pendant pyridyl functionality in mixed-valence copper complexes with methanol and copper(II) bromide

Dalton Transactions 2012, 41, 4255 - 4261（IF=4.0，第一單位）

8. Wen-guang Liu, Guang-hui Chen*, Xiao-chun Huang, Di Wu and Yun-peng Yu DFT Studies on the Interaction of an Open-Ended Single-Walled Aluminum Nitride Nanotube (AlNNT) with Gas Molecules J. Phys. Chem. C 2012, 116, 4957 – 4964（IF=4.85，第一單位）

9. Hai-xia Lin, Guang-hui Chen*, Hui-ling Liu, Dan Li, Xiao-chun Huang, Wen-guang Liu and Yu-qiu Jiao
Theoretical study on the reaction mechanism of NH2- with O2(a1Δg) J. Phys. Chem. A 2011, 115, 13581-13588（IF=2.9，第一單位）

10. Zhi Lv, Guang-hui Chen*, Dan Li, Di Wu, Xiao-chun Huang, Zhi-ru Li and Wen-guang Liu RgBF2+ complexes (Rg=Ar, Kr, and Xe): the cations with large stabilities J. Chem. Phys. 2011, 134, 154302 -154309（IF=3.0，第一單位）

11. Guo-fen Gao, Mian Li, Shun-ze Zhan, Zhi Lv, Guang-hui Chen, and Dan Li* Confined Metallophilicity within a Coordination Prism  Chem. Eur. J. 2011, 17, 4113-4117（IF=6.0，第一單位）

12. Yi Pan, Guang-hui Chen*, Di Wu, Zhi Lv, Zhi-ru Li, Dan Li, Xiaochun Huang Theoretical study on structures and stability of GeSiN and GeCP radicals Chem. Phys. Lett. 2010, 487, 171-176（IF=2.0，第一單位）

13. Zhen-bo Liu, Zhi-ru Li, Ming-hui Zuo, Qing-zhong Li, Fang Ma, Zhong-jun Li, Guang-hui Chen, Chia-chung Sun Rare gas atomic number dependence of the hyperpolarizability for rare gas inserted fluorohydrides, HRgF (Rg=He, Ar, and Kr)

J. Chem. Phys. 2009，131, 044308-044313（IF=3.1，第一單位）

14. Guang-hui Chen, Krishnan Balasubramanian Electronic states and stability of GeC2N radical Chem. Phys. Lett., 2007, 438 (4-6), 162-168. 

15. Guang-hui Chen, Yi-hong Ding, Xu-ri Huang, and Chia-chung Sun Theoretical investigation on potential energy surface of CSiNP isomers J. Mol. Struc.(TheoChem) 2006, 772(1-3), 51-64. 

16. Guang-hui Chen, Yi-hong Ding, Xu-ri Huang, Chia-chung Sun Theoretical study on structures and stability of Si2CP isomers J. Phys. Chem. A, 2005,109( 25), 5619-5624.

17．Hui-ling Liu, Xu-ri Huang, Guang-hui Chen, Yi-hong Ding, Chia-chung Sun Theoretical study on structures and stability of SiC3P isomers J. Phys. Chem. A, 2004, 108(52), 11828-11837. 

18. Guang-tao Yu, Yi-hong Ding, Xu-ri Huang, Guang-hui Chen, Au-chin Tang Theoretical study on structures and stability of NC3S isomers J. Phys. Chem. A, 2004, 108(48), 10723-10739. 

19. Hui-ling Liu, Xu-ri Huang, Guang-hui Chen, Yi-hong Ding,，Chia-chung Sun SiC3N: A Promising Interstellar Molecule with Stable Cyclic Isomers J. Phys. Chem. A, 2004, 108( 33), 6919-6927. 

20. Guang-hui Chen, Yi-hong Ding, Xu-ri Huang, Ze-sheng Li, Chia-chung Sun Theoretical investigation on the potential energy surface of Si2NP molecule J. Phys. Chem. A, 2004, 108( 24), 5268-5277. 

21. Guang-hui Chen, Yi-hong Ding, Xu-ri Huang，Jian-kang, Yu, Chia-chung Sun Si2CN: A stable nitrogen-containing radical with cyclic ground state J. Chem. Phys., 2004, 120(18), 8512-8520. 

22. Guang-hui Chen, Yi-hong Ding, Xu-ri Huang, Ze-sheng Li, Chia-chung Sun Theoretical study on structures and stability of SiC2S isomers  J. Phys. Chem. A, 2003, 107(35), 6859-6868.

23. Guang-hui Chen, Yi-hong Ding, Xu-ri Huang, Hong-xing Zhang, Ze-sheng Li, Chia-chung Sun SiC2P: A promising molecule with two stable cyclic structures J. Phys. Chem. A, 2002, 106( 43), 10408-10414. 

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