1. 有机固体材料及器件的物理化学计算

2. 载流子/电荷输运计算

3. 有机热电转换计算

4. 固体表界面相互作用计算

5. 二维材料表界面的电催化机制及其计算

6. 复杂信号处理分析及其多元统计分析

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070304-物理化学
070305-高分子化学与物理

材料物理化学计算，有机固体器件，电输运机制，电催化
化学计量学， 复杂信号分析与判断

   

分析化学

   

（1） 国家级一流本科课程“思维训练与学习力提升”, 部委级, 2020
（2） 国家精品在线开放课程“思维训练与学习力提升”, 部委级, 2018

（1） Strong dependence of the vertical charge carrier mobility on the p–p stacking distance in molecule/graphene heterojunctions, Phys.Chem.Chem.Phys, 2020, 通讯作者
（2） Highly Conducting Organic–Inorganic Hybrid Copper Sulfides CuxC6S6 (x=4 or 5.5): Ligand-Based Oxidation-Induced Chemical and Electronic Structure Modulation, Angew. Chem. Int. Ed., 2020, 通讯作者
（3） “Lewis Base-Hungry” Amorphous−Crystalline Nickel Borate−Nickel Sulfide Heterostructures by In Situ Structural Engineering as Effective Bifunctional Electrocatalysts toward Overall Water Splitting, ACS Appl. Mater. Interfaces, 2020, 通讯作者
（4） Tuning the Ambipolar Character of Copolymers with Substituents: A Density Functional Theory Study, J. Phys. Chem. Lett., 2020, 通讯作者
（5） Butterfly-like Tetraazaacenequinodimethane Derivatives: Synthesis, Structure and Halochromic Properties, Chem Asian J., 2020, 通讯作者
（6） 高催化活性M-BHT(M=Co、Cu)电催化 还原CO2为CH4的 密度泛函理论研究, 高等学校化学学报, 2020, 通讯作者
（7） The antioxidant activity and catalytic mechanism of Schiff base diphenylamines at elevated temperatures, Industrial & Engineering Chemistry Research, 2020, 通讯作者
（8） Stereodefined Codoping of sp-N and S Atoms in Few-Layer Graphdiyne for Oxygen Evolution Reaction, Journal of the American Chemical Society, 2019, 通讯作者
（9） Impact of Stoichiometry and Fluorine Atoms on the Charge Transport of Perylene-F(4)TCNQ, Journal of Physical Chemistry Letters, 2019, 通讯作者
（10） Tuning Surface Lattice Strain toward a Pt-Skin CoPtx Truncated Octahedron for Hydrogen Evolution Reaction, Journal of Physical Chemistry C, 2019, 通讯作者
（11） N,P-coordinated fullerene-like carbon nanostructures with dual active centers toward highly-efficient multi-functional electrocatalysis for CO2RR, ORR and Zn-air battery, Journal of Materials Chemistry A, 2019, 通讯作者
（12） Vertical Organic Field-Effect Transistors, Advanced Functional Materials, 2019, 通讯作者
（13） Exploring Peltier effect in organic thermoelectric films, Nature Communications, 2018, 通讯作者
（14） Nitrogen-Rich D-π-A Structural Carbon Quantum Dots with a Bright Two-Photon Fluorescence for Deep-Tissue Imaging, CS Applied Bio Materials, 2018, 通讯作者
（15） Few-layer graphdiyne doped with sp-hybridized nitrogen atoms at acetylenic sites for oxygen reduction electrocatalysis, Nature Chemistry, 2018, 通讯作者
（16） Solution Adsorption Formation of a pi-Conjugated Polymer/Graphene Composite for High-Performance Field-Effect Transistors, Advanced Materials, 2018, 通讯作者
（17） Conjugated-Backbone Effect of Organic Small Molecules for n-Type Thermoelectric Materials with ZT over 0.2, Journal of the American Chemical Society, 2017, 通讯作者

（1） 中小学教学行为观测与教师教学行为特征评估分析, 首都师范大学出版社, 2018-01, 第 1 作者