安徽工业大学化学与化工学院范果红

aiyu

姓名        范果红        性别        男        最高学历        博士
职称/职务        讲师/硕导
研究方向        催化剂理论设计，材料第一性能原理计算，量子化学计算方法研究
邮箱        ghfan8@ahut.edu.cn，fgh1101@163.com
学习工作经历        2014.5—现在：安徽工业大学化工学院应用化学系，讲师。
2007.9—2013.12：中科院大连化学物理研究所，物理化学专业，理学博士。
2003.9—2007.6：湘潭大学，材料物理专业，理学学士。
主要科研项目及成果        近期发表的论文和主持的科研项目：
期刊论文:
1. Guohong Fan, Sheng Zhu, Ke Ni, Hong Xu*, Theoretical study of the adsorption of aromatic amino acids on a single-wall boron nitride nanotube with empirical dispersion correction, Canadian Journal of Chemistry, 2017, 95, 710-716.
2. Guo-hong Fan, Sheng Zhu, Xiao-kun Li, Ke Ni, Hong Xu*, Ab initio investigation of pristine and doped single-walled boron nitride nanotubes as acetone sensor, Computational and Theoretical Chemistry, 2017, 1115, 208-216.
3. Guohong Fan, Sheng Zhu, Hong Xu*, Density-functional theory study of the interaction mechanism and optical properties of flavonols on the boron nitride nanotubes, International Journal of Quantum Chemistry, DOI: 10.1002/qua.25514.
4. Hong Xu, Ke Ni, Xiaokun Li, Sheng Zhu, Guohong Fan*, Comparative studies of leached Pt‐Fe and Pt‐Co catalysts for CO oxidation reactions, Chinese Journal of Catalysis, 2017, 38, 1261–1269.
5. Hong Xu, Ke Ni, Xiaokun Li, Guangzong Fang and Guohong Fan*, Structural transformation of Pd-α-Fe2O3 and Pd-γ-Fe2O3 catalysts and application in the CO oxidation reaction, RSC Advances, 2017, 7, 51403-51410.
6. Hong Xu, Ke Ni, Xiao-kun Li, Sheng Zhu, Guo-hong Fan*, First-principles study of CO catalytic oxidation on Pd-doped single wall boron nitride nanotube, Computational and Theoretical Chemistry, 2017, 1115, 37-44.
7. Guo-Hong Fan, Xing Li, Jian-Yong Liu*, Guo-Zhong He, Excited-state properties of a blue luminescent covalent organic framework by the time-dependent density-functional tight-binding method, Computational and Theoretical Chemistry, 2014, 1030: 17-24.
8. Guo-hong Fan, Ke-li Han*, Guo-zhong He, Time-dependent density functional-based tight-bind method efficiently implemented with openmp parallel and GPU acceleration, Chinese Journal of Chemical Physics, 2013, 26(6): 635-645.
9. Guohong Fan, Jianyong Liu*, Guozhong He, Nonadiabatic dynamics study of bridged-azobenzene by the time-dependent density functional tight-binding method, Computational and Theoretical Chemistry, 2013, 1023:10-18.
10. Guo-Hong Fan, Ke-Li Han, Efficient Implementation of Time-Dependent Density Functional-Based Tight-Bind Method on Multi-core and GPU System, Commun. Comput. Chem., 2013, 1, 2,124-131.
科研项目:
1. 通用异构并行密度泛函计算方法研究（主持，国家自然科学基金）；
2. Pd-Fe催化剂的CO氧化反应性能机理研究（参与，国家自然科学基金）；