个人简介
汉族,副教授,硕士生导师,理学博士(北京师范大学)。曾获2016年北京师范大学优秀毕业生,北京师范大学学业一等奖学金。近年来在Angew. Chem. Int. ed., Phys. Chem. Chem. Phys.等重要期刊发表研究论文20多篇,担任Phys. Chem. Chem. Phys.等期刊审稿人
讲授课程
《物理化学》、《结构化学》、《化学前沿》
主持及参与的科研项目
国家自然科学基金青年科学基金项目:邻芳基苯酚类化合物光化学反应机理的理论研究,2018.01-2020.12,主持,已结题
中央民族大学青年教师科研能力提升计划项目:2-萘基苯酚激发态质子转移过程的理论研究,2019.01-2019.12,主持,已结题
国际(地区)合作与交流项目:QM/MM 激发态方法及其在蓝光受体光化学中的应用,2015.01-2019.12,参加,已结题
优秀青年科学基金项目:理论及计算光化学,2015.01-2017.12,参加,已结题
国家自然科学基金青年科学基金项目:溶液光化学反应的QM(AIMS)/MM 非绝热动力学模拟,2015.01-2017.12,参加,已结题
研究领域
理论与计算化学在环境、生态、生物和化学体系中光化学反应机理的研究及应用
近期论文
查看导师最新文章
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Excited-state Relaxation Mechanisms of 2,2’-(1-Phenyl-1H-1,2,4-triazole-3,5-diyl)diphenol: Single or Double Proton Transfer
Non-adiabatic dynamics simulations of the S1 excited-state relaxation of diacetyl phenylenediamine
Combined QM (MS-CASPT2)/MM Studies on Photocyclization and Photoisomerization of a Fulgide Derivative in Toluene Solution
Excited-state Photochemistry Dynamics of 2-(1-naphthyl) phenol: Electronic Structure Calculations and Non-adiabatic Dynamics Simulations
Excited-State Deactivation Mechanism of 3,5-bis(2-hydroxyphenyl)-1H-1,2,4-triazole: Electronic Structure Calculations and Nonadiabatic Dynamics Simulations
Photochemical and photophysical properties of cis-stilbene molecule by electronic structure calculations and nonadiabatic surface-hopping dynamics simulations
Electrochemical oxidation of sulfamethoxazole in BDD anode system: Degradation kinetics, mechanisms and toxicity evaluation
Photochemical mechanism of 1,5-benzodiazepin-2-one: Electronic structure calculations and nonadiabatic surface-hopping dynamics simulations
Excited-State Decay Pathways of Flavin Molecules in Five Redox Forms: The Role of Conical Intersections
Electronic Structure Calculations and Nonadiabatic Dynamics Simulations on Excited-State Relaxation of Pigment Yellow 101
A Theoretical Study of Ruthenium Complexes with 2,2’-Biimidazole-like Ligands: Structural, Optical and Emissive Properties
Theoretical Studies on the Photochemistry of Pentose Amino-oxazoline, a Hypothetical Intermediate Product in Prebiotic Synthetic Scenario of RNA Nucleotides
Theoretical study on photooxidation mechanism of ruthenium complex [Ru(II)-(bpy)2 (TMBiimH2 )](2+) with molecular oxygen
Abiotic reduction of trifluralin and pendimethalin by sulfides in black-carbon-amended coastal sediments
Excited-State Proton-Transfer-Induced Trapping Enhances the Fluorescence Emission of Locked GFP Chromophore
How Photoisomerization Drives Peptide Folding and Unfolding: Insights from QM/MM and MM Dynamics Simulations
How Photoisomerization Drives Peptide Folding and Unfolding: Insights from QM/MM and MM Dynamics Simulations
Photophysics of Auramine-O: Electronic Structure Calculations and Nonadiabatic Dynamics Simulations
Photodissociation dynamics of CH3C(O)SH in argon matrix: A QM/MM nonadiabatic dynamics simulation
Surface-Hopping Dynamics Simulations of Malachite Green: A Triphenylmethane Dye
Excited-state ring-opening mechanism of cyclic ketones: a MS-CASPT2//CASSCF study
Excited-State Intramolecular Proton Transfer to Carbon Atoms: Nonadiabatic Surface-Hopping Dynamics Simulations
Photodecarbonylation Mechanism of Cyclopropenone in the Gas Phase: Electronic Structure Calculation and AIMS Dynamics Simulation