2021汕頭大學(xué)陳廣慧教授課題組誠(chéng)招計(jì)算化學(xué)方向公費(fèi)碩士生
一、汕頭大學(xué)理學(xué)院化學(xué)系理論模擬方向招生，導(dǎo)師陳廣慧教授研究興趣：
1、MOF材料設(shè)計(jì)與應(yīng)用：采用材料基因組學(xué)和機(jī)器學(xué)習(xí)進(jìn)行高通量篩選
2、抗癌靶向藥物的篩選與設(shè)計(jì)
對(duì)本課題組研究方向有興趣的同學(xué)請(qǐng)及時(shí)聯(lián)系，今年招生有兩個(gè)名額。
聯(lián)系方式：Email: 150462936@qq.com

二、汕頭大學(xué)研究生獎(jiǎng)助學(xué)金方案請(qǐng)看以下鏈接：
https://www.gs.stu.edu.cn/yjszs/jxj.htm
注明：一經(jīng)錄取，均不用交學(xué)費(fèi)，并享受每年6000元的助學(xué)金。

三、對(duì)復(fù)試生的要求：化學(xué)或藥學(xué)專業(yè)本科畢業(yè)，英語和計(jì)算機(jī)成績(jī)良好。

四、近幾屆畢業(yè)生去向：
西班牙留學(xué)、中科院、北京科技大學(xué)、香港城市大學(xué)等高校攻讀博士；企業(yè)高管。

五、陳廣慧教授簡(jiǎn)歷
1、個(gè)人簡(jiǎn)介
陳廣慧：男，1972年生，博士，教授，長(zhǎng)期從事分子異構(gòu)化及反應(yīng)機(jī)理的理論化學(xué)計(jì)算研究。1999年進(jìn)入吉林大學(xué)理論化學(xué)計(jì)算國(guó)家重點(diǎn)實(shí)驗(yàn)室后，便開始系統(tǒng)地學(xué)習(xí)量子化學(xué)知識(shí)和從事理論化學(xué)計(jì)算科學(xué)研究。2002年以來發(fā)表有關(guān)小分子結(jié)構(gòu)與性質(zhì)、離子-分子反應(yīng)機(jī)理、配合物光譜和AlN納米管功能化的研究論文20余篇，均被SCI收錄，大多發(fā)表在J. Phys. Chem.、 J. Chem. Phys.等期刊，在理論化學(xué)計(jì)算領(lǐng)域具有一定的經(jīng)驗(yàn)。于2005、2007年先后赴美國(guó)加州州立大學(xué)和香港大學(xué)訪學(xué)，目前主要針對(duì)金屬有機(jī)框架（MOF）材料設(shè)計(jì)及應(yīng)用、藥物設(shè)計(jì)進(jìn)行研究。
2、受教育經(jīng)歷
•        1999-2004，吉林大學(xué)理論化學(xué)計(jì)算國(guó)家重點(diǎn)實(shí)驗(yàn)室，碩博聯(lián)
3、研究工作經(jīng)歷
•        2005-2006，美國(guó)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(jí)研究助理
•        2008-至今，汕頭大學(xué)，理學(xué)院化學(xué)系  教授，碩導(dǎo)
4、部分發(fā)表論文
[1]        Wang-qiang Lin, Xue-lian Xiong, Heng Liang and Guang-hui Chen*, High-throughput Computational Screening of Metal-Organic Frameworks for Kr/Xe Adsorption Separation: A Structure-Property Relationship Based Screening Strategy, ACS Applied Materials & Interfaces, 2021, Minor Revision.
[2]        Heng Liang, Kun Jiang, Tong-An Yan and Guang-Hui Chen∗, XGBoost: An Optimal Machine Learning Model with Just Structural Features to Discover MOF Adsorbents of Xe/Kr, ACS Omega, 2021, Accepted. DOI: 10.1021/acsomega.1c00100.（封面文章）
[3]        Wang-qiang Lin, Fang Li, Guang-hui Chen∗, Song-tao Xiao, Ling-yu Wang, Qiang Wang, A study on the adsorptions of SO2 on pristine and phosphorus-doped silicon carbide nanotubes as potential gas sensors, Ceramics International, 2020, 46, 25171-25188.
[4]        Wang-qiang Lin, Song-tao Xiao, Hui-bo Li, Ying-gen Ouyang, Ling-yu Wang, Qiang Wang, Guang-hui Chen∗, Theoretical study of NO2 adsorption on SiCNT and P-doped SiCNT. Physica E: Low-dimensional Systems and Nanostructures, 2020, 114519.
[5]        Xue-Lian Xiong, Guang-Hui Chen*, Songtao Xiao, Ying-Gen Ouyang, Hui-Bo Li, and Qiang Wang, New Discovery of Metal−Organic Framework UTSA-280: Ultrahigh Adsorption Selectivity of Krypton Over Xenon The Journal of Physical Chemistry C, 2020, 126, 14603-14612
[6]        Jiao-jiao Qian, Guang-hui Chen*, Song-tao Xiao, Hui-bo Li Switching Xe/Kr adsorption selectivity in modified SBMOF-1: a theoretical study RSC Advances, 2020, 10, 17195-17204.
[7]        Chong-Wei Ding, Wenzhi Luo, Jie-Yi Zhou, Xin-Jie Ma, Guang-Hui Chen, Xiao-Ping Zhou*, and Dan Li*, Hydroxo Iron(III) Sites in a Metal-Organic Framework: Proton-Coupled Electron Transfer and Catalytic Oxidation of Alcohol with Molecular Oxygen, ACS Appl. Mater. Interfaces, 2019, 11, 45621-45628.
[8]        Qiang Wang,* Pengfei Liu, Xin Bian, Jianmei Huang, Wei-qi Li, Guang-hui Chen, Yanhui Yang*, Adlayer-substrate Interactions in Controlled Growth of Graphene/h-BN Heterostructure on Ni(111) and Cu(111) Surfaces, Applied Surface Science, 2019, 480, 154-161.
[9]        Wen-zhi Luo, Guang-hui Chen,* Song-tao Xiao,* Qiang Wang, Ze-kun Huang and Ling-yu Wang, The Enzyme-Like Catalytic Hydrogen Abstraction Reaction Mechanisms of Cyclic Hydrocarbons with Magnesium-Diluted Fe-MOF-74, RSC Advances, 2019, 9, 23622-23632.
[10]        Yi-Bing Su, Yong-Jun Yuan, Xiao-Le Liu, Guang-Hui Chen,* Xin Chen,* Zhen-Tao Yu,* and Zhi-Gang Zou, A Heterobimetallic AuIII-PtII Photocatalyst for Water Reduction to Hydrogen, Chemistry–An Asian Journal, 2019, 14, 527-531.
[11]        Ling-Xia Yang, Wan-Fa Yang, Yong-Jun Yuan, Yi-Bing Su, Miao-Miao Zhou, Xiao-Le Liu, Guang-Hui Chen,* Xin Chen,* Zhen-Tao Yu,* and Zhi-Gang Zou, Visible-Light-Driven Hydrogen Production and Polymerization using Triarylboron-Functionalized Iridium(III) Complexes, Chemistry–An Asian Journal, 2018, 13, 1699-1709.
[12]        Shun-Ze Zhan,* Xia Jiang, Ji Zheng, Xin-Da Huang, Guang-Hui Chen and Dan Li,*A Luminescent Supramolecular Cu2I2 (NH3) 2-Sandwiched Cu3 (pyrazolate)3 Adduct as a Temperature Sensor, Dalton Transactions, 2018, 47, 3679-3683.
[13]        Qiang Wang,* Xianfei Lu, Yanzhong Zhen, Wei-qi Li, Guang-hui Chen, and Yanhui Yang,* Structure, Stability, Electronic, Magnetic, and Catalytic Properties of Monometallic Pd, Au, and Bimetallic Pd-Au Core-Shell Nanoparticles, The Journal of chemical physics, 2018, 149, 244307.
[14]        Ya-Dong Yu, Ling-Bin Meng, Qiu-Cheng Chen, Guang-Hui Chen* and Xiao-Chun Huang,* Substituent Regulated Photoluminescent Thermochromism in A Rare Type of Octahedral Cu4I4 Clusters, New Journal of Chemistry, 2018, 42, 8426-8437.
[15]        Fu-hai Li, Dai-rong Hu, Ya-hui Yuan, Bin-bin Luo, Yi-bing Song, Song-tao Xiao, Guang-hui Chen, Yi-wen Fang, and Fu-shen Lu, Zeolite Y Encapsulated Cu (II) and Zn (II)-Imidazole-Salen Catalysts for Benzyl Alcohol Oxidation, Molecular Catalysis, 2018, 452, 75-82.
[16]        Wei-Guang Jin, Wei Chen, Pei-Hang Xu, Xin-Wen Lin, Xiao-Chun Huang,* Guang-Hui Chen, Fushen Lu, and Xiao-Ming Chen, An Exceptionally Water Stable Metal–Organic Framework with Amide-Functionalized Cages: Selective CO2/CH4 Uptake, Removal of Antibiotics and Dyes from Water, Chemistry-A European Journal (Hot Paper), 2017, 23, 13058–13066.
[17]        Xia Jiang, Guang-hui Chen,* Min-qiang Gu, Qiang Wang, Di Wu,* Theoretical Study and Design of Phosphorescent Cyclometalated (C^C*)PtII(acac) Complexes: The Substituent Effect Controls the Radiative and Nonradiative Decay Processes, The Journal of Physical Chemistry A, 2017, 121, 6231-6242.
[18]        Lu Wang, Qiang Wang,* Jianmei Huang, Wei-qi Li, Guang-hui Chen and Yanhui Yang,* Interface and Interaction of Graphene Layers on SiC (0001 [combining macron]) Covered with TiC (111) Intercalation, Physical Chemistry Chemical Physics, 2017, 19, 26765-26775.
[19]        Xiao-le Liu, Guang-hui Chen,* Xiu-Jun Wang,* Peng Li, Yi-bing Song and Rui-yan Li, Theoretical study on the gas adsorption capacity and selectivity of CPM-200-In/Mg and CPM-200-In/Mg-X(-X = -NH2, -OH, -N, -F), Physical Chemistry Chemical Physics, 2017, 19, 29963-29974.
[20]        Yong-Hui Li, Xiao-Le Liu, Zhen-Tao Yu,* Zhao-Sheng Li, Shi-Cheng Yan, Guang-Hui Chen and Zhi-Gang Zou, Osmium(II) Complexes for Light-Driven Aerobic Oxidation of Amines to Imines, Dalton Transactions, 2016, 45, 12400-12408.
[21]        Zhen-Tao Yu,* Xiao-Le Liu, Yong-Jun Yuan, Yong-Hui Li, Guang-Hui Chen and Zhi-Gang Zou, Evaluation of Bis-Cyclometalated Alkynylgold(III) Sensitizers for Water Photoreduction to Hydrogen, Dalton Transactions, 2016, 45, 17223-17232.
[22]        Wei Chen, Guang-Hui Chen,* Di Wu and Qiang Wang, BNg3 F3: the first three noble gas atoms inserted into mono-centric neutral compounds–a theoretical study, Physical Chemistry Chemical Physics, 2016, 18, 17534-17545.
[23]        Xin Bian, Qiang Wang,* Xinyan Wang, Lu Wang, Wei-qi Li, Guang-hui Chen and Hongjun,* GrapheneLayers on Bimetallic Ni/Cu(111) Surface and Near Surface Alloys in Controlled Growth of Graphene, RSC Advances, 2016, 6, 74973-74981.
[24]        Hong Cai, Mian Li, Xiao-Rong Lin, Wei Chen, Guang-Hui Chen, Xiao-Chun Huang, and Dan Li*, Spatial, Hysteretic, and Adaptive Host–Guest Chemistry in a Metal– Organic Framework with Open Watson–Crick Sites, Angewandte Chemie International Edition, 2015, 54, 10454-10459.
[25]        Zhimin Yang, Qiang Wang,* Xiaoye Shan, Wei-qi Li, Guang-hui Chen, and Hongjun Zhu, DFT study of Fe-Ni core-shell Nanoparticles: Stability, Catalytic Activity, and Interaction with Carbon Atom for Single-Walled Carbon Nanotube Growth, The Journal of chemical physics, 2015, 142, 074306.
[26]        Hailong Liang, Baojie Chai, Guanghui Chen,* Wei Chen, Sheng Chen, Hailan Xiao, Shujuan Lin, Electric Field-driven Acid-base Transformation: Proton Transfer from Acid(HBr/HF) to Base(NH3/H2O), Chemical Research in Chinese Universities, 2015, 31, 418-426.
[27]        Xiaoye Shan, Qiang Wang,* Xin Bian, Wei-qi Li, Guang-hui Chen and Hongjun Zhu,*Graphene layers on Si-face and C-face surfaces and interaction with Si and C atoms in layer controlled graphene growth on SiC substrates, RSC Advances, 2015, 5, 78625-78633.
[28]        Hui Wu, Guang-hui Chen,* Yun-peng Yu, Di Wu, Qiang Wang, Theoretical Exploration of the Half-Metallicity of Graphene Nanoribbons/Boron Nitride Bilayer System, Computational Materials Science, 2014, 95, 384-392.
[29]        Kefu Gao, Guanghui Chen,* and Di Wu, A DFT Study on the Interaction between Glycine Molecules/Radicals and the (8, 0) SiCNT, Physical Chemistry Chemical Physics, 2014, 16, 17988-17997.
[30]        Yunmei Zhen, Guangrong Qin, Cheng Luo, Hualiang Jiang, Kunqian Yu,* Guanghui Chen,* Exploring the RING-Catalyzed Ubiquitin Transfer Mechanism by MD and QM/MM Calculations, PloS one, 2014, 9, e101663.
[31]        Bing Zhong, Yunmei Zhen, Guangrong Qin, Huaiyu Yang, Hualiang Jiang,  Guanghui Chen,* Kunqian Yu,* Progress in Studies of Structure, Mechanism and Antagonists Interaction of GPCR Co-Receptors for HIV, Current pharmaceutical biotechnology, 2014, 15, 938-950.
[32]        Hai-long Liang, Guang-hui Chen,* Feng-long Gu,* Theoretical Study on the Mechanism of Reaction of CHF2 with NO2, Computational and Theoretical Chemistry, 2013, 1010, 1-10.
[33]        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.
[34]        Wen-guang Liu, Guang-hui Chen,* Xiao-chun Huang, Di Wu, Yun-peng Yu, DFT Studies on the Interaction of an Open-Ended Single-Walled Aluminum Nitride Nanotube (AlNNT) with Gas Molecules, The Journal of Physical Chemistry C, 2012, 116, 4957-4964.
[35]        Hai-xia Lin, Hai-long Liang, Guang-hui Chen,* Feng-long Gu,* Wen-guang Liu, Shao-fei Ni, Theoretical Study on the Reaction Mechanisms of CH3O– with O2(X3Σg–) and O2(a1Δg), The Journal of Physical Chemistry A, 2012, 116, 11656-11667.
[36]        Guo-Fen Gao, Mian Li, Shun-Ze Zhan, Zhi Lv, Guang-hui Chen, and Dan Li,* Confined Metallophilicity within a Coordination Prism, Chemistry–A European Journal, 2011, 17, 4113-4117.
[37]        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, The Journal of chemical physics, 2011, 134, 154302.
[38]        Hai-xia Lin, Guang-hui Chen,* Hui-ling Liu, Dan Li, Xiao-chun Huang, Wen-guang Liu, Yu-qiu Jiao, Theoretical Study on the Reaction Mechanism of NH2– with O2 (a1Δg), The Journal of Physical Chemistry A, 2011, 115, 13581-13588.
[39]        Yi Pan, Guang-hui Chen,* Di Wu, Zhi Lv, Zhi-ru Li, Dan Li, Xiao-chun Huang, Theoretical Study on Structures and Stability of GeSiN and GeCP Radicals, Chemical Physics Letters, 2010, 487, 171-176.
[40]        Zhen-Bo Liu, Zhi-Ru Li, Ming-Hui Zuo, Qing-Zhong Li, Fang Ma, Zong-Jun Li, Guang-hui Chen,* and Chia-Chung Sun, Rare Gas Atomic Number Dependence of the Hyperpolarizability for Rare Gas Inserted Fluorohydrides, HRgF (Rg=He, Ar, and Kr), The Journal of chemical physics, 2009, 131, 044308. 返回小木蟲查看更多