个人简介
教育背景与工作(挂职)经历:
2014.7-至 今 教授,硕导,南京林业大学
2013.9-2014.7 副教授,硕导,南京林业大学
2010.3-2013.2 助理教授,韩国庆熙大学
2007.7-2010.2 博士后,南京航空航天大学
2003.3-2007.6 博士,应用化学专业,上海交通大学
科研项目:
1.国家自然科学基金青年基金:溶剂辅助激发态链式长程多质子转移反应动力学的理论研究,2015.1-2017.12,25万,主持,已结题。
2.江苏省自然科学基金青年基金:复杂氢键体系的激发态链式多质子转移反应动力学的理论研究,2014.7-2017.6,20万,主持,已结题。
3.教育部留学回国科研启动基金:溶液环境中激发态多质子传递反应动力学的理论研究,2015.1-2017.12,3万,主持,已结题。
4. 南京林业大学高层次人才引进科研基金:多质子转移反应机理的理论研究,2014.7-2017.6,12万,主持,已结题。
研究领域
质子转移反应反应机理,弱相互作用,功能材料性质模拟等
近期论文
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1.Jiacheng Yi, Hua Fang*,Effect of different alkyl groups on excited-state tautomerization of 7AI-azaindole-H2O: A theoretical study,Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy,2018,202,58-64.
2.Hua Fang⁎, Yanxialei Jiang,Theoretical study on excited-state multiple proton-transfer process of 7-azaindole with ammonia and mixed water-ammonia: Stepwise or concerted?,Journal of Photochemistry & Photobiology A: Chemistry,2018,364,492-502.
3.Jiacheng Yi, Hua Fang*,Theoretical study on the substituent effect of halogen atom at different position of 7-azaindole-water derivatives: relative stability and excited-state proton-transfer mechanism,Structural Chemistry,2018,29,1341-1350.
4.Jiacheng Yi, Hua Fang*,Theoretical Study on the Substituent Effect on the Excited-State Proton Transfer in the 7-Azaindole-Water Derivatives,Photochemistry and Photobiology,2018,94,27-35.
5.Hua Fang*,Yongho Kim, Hydrogen‑bonded channel‑dependent mechanism of long‑range proton transfer in the excited‑state tautomerization of 7‑hydroxyquinoline: a theoretical study, Theor. Chem. Acc.,2017,136,28.
6.Jiacheng Yi, Hua Fang*, Theoretical investigation on the water-assisted excited-state proton transfer of 7-azaindole derivatives: substituent effect,J. Mol. Model,2017,23,312.
7.Hua Fang*, Ground-state long-range proton transfer controlled by proton-accepting ability of hydrogen-bonded chains: a theoretical study, Progress in Reaction Kinetics and Mechanism,2017,42,384-396.
8.Hua Fang*, Theoretical study on ground-state proton/H-atom exchange in formic acid clusters through different H-bonded bridges,J. Chem. Sci.,2016,128,1497-1506.
9.Hua Fang*,Theoretical study on excited-state proton transfer via hydrogen-bonded ethanol (EtOH) wire for 7AI in the gas phase,Theor. Chem. Acc.,2015,134,142.
10.Hua Fang, Binh Khanh Mai and Yongho Kim*,Excited-State Multiple Proton Transfer Depending on the Acidity and Basicity of Mediating Alcohols in 7-Azaindole–(ROH)2 (R=H, CH3) Complexes: A Theoretical Study,Photochemistry and Photobiology,2015,91,306-314.
11.Hua Fang, Yongho Kim*,Excited-State Tautomerization of 7-Azaindole in Nonpolar Solution: A Theoretical Study Based on Liquid-Phase Potential Surfaces of Mean Force, J. Chem. Theor. Computa.,2013,9,3557-3566.