麻娜娜个人简介

教育与研究经历：

2004.09-2008.06 湖北师范大学化学与环境工程学院 化学教育专业 理学学士

2008.09-2014.06 东北师范大学化学学院 物理化学专业 理学博士

2021.09-2022.09 德国Ulm大学理论化学研究所 理论计算化学 访问学者

2014.07-现在 betway官方app 化学化工学院 有机化学研究所 化学教师

研究领域与兴趣：

应用量子化学：

1. 硼烷类化合物的电子结构以及非线性光学性质的理论研究

2. 形成机理、催化反应机理的理论研究

主讲课程：

1. 《谱学导论》(本科生课程)

2. 《有机化学实验》(本科生课程)

3. 《理论计算在化学反应和材料设计中的应用》(研究生课程)

主持的科研项目：

1.国家自然科学基金：“氧化还原控制层状夹心金属碳硼烷作为非线性光学多态开关的DFT研究” (21603062, 2017.01-2019.12)

2. 河南省自然科学基金面上项目：“金属配合物催化二氧化碳硼氢化反应新机制的理论研究”(222300420473, 2022.01-2023.12)

3. 河南省教育厅科学技术研究重点项目：“非线性光学开关效应检测金属阳离子的DFT研究” (15A150015, 2015.01-2017.12)

4. betway官方app 面上基金培育项目(2020.01-2022.12)

5.betway官方app 青年科学基金 (2015QK11, 2016.01-2018.12)

6.betway官方app 博士启动基金 (qd14124, 2015.01-2017.12)

获奖情况：

1.河南省教育系统教学技能竞赛(高校理科) 一等奖

2. 河南省教学标兵

3. betway官方app 第五届青年教师课堂教学比赛二等奖

4. betway官方app 第五届课堂教学十佳青年教师

5. 博士研究生国家奖学金

代表性论文(第一及通讯作者)：

30.Nana Ma*, Weiyi Cheng, Changgeng Wei, Shujun Li, Guisheng Zhang*, Mechanism of methanol synthesis from CO2 on Cu/CeO2 and Cu/W-CeO2: a DFT investigation into the nature of W-doping,J. Mater. Chem. A,2024,DOI: 10.1039/D3TA06569C.

29.Nana Ma*, Yajing Bian, Weiyi Cheng, Yameng Li, Qingjin Wang, Shujun Li*,A theoretical exploration of the second-orderNLO properties of linked sandwich double-layeredmetallacarboranes: charge transfer mediated bylinker groups,Phys. Chem. Chem. Phys.,2023,25, 22304.

28.Nana Ma*, Lanxin Zhou, Yameng Li, Hao Wu, Shujun Li*, Guisheng Zhang*,Theoretical Insight into the Mechanism of Cu(I)-Catalyzed [2 + 2 + 1]Cycloaddition to β‑Pyrrolinones: Azaheterocycle Formation andAssisted Dehydrogenation with Solvent MeNO2,J. Org. Chem.2023, 88, 10670.

27.Nana Ma*, Wenyue Guo, Tongxin Liu, Guisheng Zhang*,Theoretical mechanism study on the electrochemical benzylation of [60]fullerene derivatives,Phys. Chem. Chem. Phys.,2023,25, 7251.

26. Chenhao Tu,Nana Ma*, Qingli Xu, Wenyue Guo, Lanxin Zhou, Guisheng Zhang*,Computational study on the mechanism of metal-free photochemical borylation of aryl halides,Int. J. Quantum Chem.,2022,122, e26920.

25.Nana Ma*, Wenyue Guo, Zhu Zhu, Guisheng Zhang*, Third-order nonlinear optical property contrast as self-assembly recognition for nanorings@C60,New J. Chem.,2022,46, 4927.

24.Nana Ma*, Qingli Xu, Guisheng Zhang*, Theoretical insights on boron reducing agent for the reduction of carbonyl compounds,Phys. Chem. Chem. Phys.,2021,23, 19111.

23.Nana Ma*, Qingli Xu, Chenhao Tu, Wenyue Guo, Guisheng Zhang*, Ni Pincer Complex Catalytic Hydroboration of CO2: A DFT Study on the Influence of Borane Reductants on Selective Reduction,New J. Chem.,2021,45, 11275.

22.Nana Ma*, Chenhao Tu, Qingli Xu, Wenyue Guo, Jie Zhang*, Guisheng Zhang*, Computational Study on the Mechanism of Hydroboration of CO2 Catalysed by POCOP Pincer Nickel Thiolate Complexes: Concerted Catalysis and Hydride Transfer by a Shuttle,Dalton Trans.,2021,50, 2903.

21. Qing Huang, Qian Niu,Nana Ma*, Longzhang Dong, Shunli Li*, Donesheng Li, Yuepeng Cai, Yaqian Lan*, Axial Cl/Br Atom-Mediated CO2 Electroreduction Performance in a Stable Porphyrin-based Metal-Organic Framework,Chem. Commun.,2020,56, 14817.

20. HaoWu,Nana Ma*, Mengxiao Song, Guisheng Zhang*, Dimethyl Sulfoxide-Aided Copper(0)-Catalyzed Intramolecular Decarbonylative Rearrangement of N-aryl Isatins Leading to Acridones,Chin. Chem. Lett.,2020,31, 1580.

19.Nana Ma*, Mengxiao Song, Qi Meng, Changgeng Wei, Guisheng Zhang*, Theoretical Insight into the Solvent Effect on the Stoichiometric Reduction of Carbonyl Compounds by Ammonia Borane and N-Methyl Amine Borane,Int. J. Quantum Chem.,2020,120, e26162.

18.Nana Ma*, Mingyue Lv, Tongxin Liu, Mengxiao Song, Yan Liu, Guisheng Zhang*, Second-order nonlinear optical properties of [60]fullerene-fused dihydrocarboline derivates: a theoretical study on switch effect,J. Mater. Chem. C,2019,7, 13052. (hot paper, 封面文章)

17. Xi-Meng Chen⁺,Nana Ma⁺, Xin-Ran Liu, Changgeng Wei, Chong-Chao Cui, Bu-La Cao, Yanhui Guo*, Lai-Sheng Wang*, Qinfen Gu, Xuenian Chen*, Facile Synthesis of Unsolvated Alkali Metal Octahydrotriborate Salts MB3H8 (M=K, Rb, and Cs), Mechanisms of Formation, and the Crystal Structure of KB3H8,Angew. Chem. Int. Ed.,2019,58, 2720.

16. Tong-Xin Liu*, Shuaishuai Yue, Changgeng Wei,Nana Ma*, Pengling Zhang, Qingfeng Liu, Guisheng Zhang*, Solvent-promoted catalyst-free regioselective N-incorporation multicomponent domino reaction: rapid assembly of p-functionalized [60]fullerene-fused dihydrocarbolines,Chem. Commun.,2018,54, 13331.

15.Nana Ma, ChanggengWei, Shujun Li*, Guisheng Zhang*, A Theoretical Insight on Ethylene Polymerization Catalyzed by Carborane-Containing Metal Complexes: the Role of Carborane,Dalton Trans.,2018,47, 14421.

14.Nana Ma, Jinjin Gong, Jie Zhang, Shangning Han, Guisheng Zhang*,Theoretical Exploration of the Layered Sandwich Cobaltacarborane as a Multi-State NLO Molecular Switch Triggered by Redox,J. Phys. Chem. C,2018,122, 6818.

13. Jie Zhang*, Ting Liu, Changgeng Wei, Jiarui Chang, Qiang-qiang Ma, Shujun Li,Nana Ma*,Xuenian Chen*,The Reactivity of Mercapto Groups against Boron Hydrides in Pincer Ligated Nickel Mercapto Complexes,Chem. Asian J.2018,13, 3231.

12. Xi-Meng Chen⁺,Nana Ma⁺, Qianfan Zhang, Jin Wang, Xiaoge Feng, Changgeng Wei, Lai-Sheng Wang*, Jie Zhang*, Xuenian Chen*, Elucidation of the Formation Mechanisms of the Octahydrotriborate Anion (B3H8−) through the Nucleophilicity of the B−H Bond,J. Am. Chem. Soc.,2018,140, 6718.

11.Nana Ma, Jinjin Gong, Shujun Li, Jie Zhang, Yongqing Qiu*, Guisheng Zhang*,Second-order NLO responses of two-cavity inorganic electrides Li_nB₂₀H₂₆(n = 1, 2): evolutions with increasing excess electron number and various B–B connection sites of B₂₀H₂₆,Phys. Chem. Chem. Phys.,2017,19, 2557.

10.Nana Ma, Shujun Li, Likai Yan, Wenyong Wang, Yongqing Qiu*, Guisheng Zhang*,Electronic Properties of Polyoxometalate Derivatives [(C₂B₉H₁₁)M'M₅O₁₈]^n-(M '=Ti^IV, Mo^VI, W^VI; M=Mo^VI, W^VI): Protonation, Electronic Spectra, and Redox Properties,Int. J. Quantum. Chem.,2016,116,396.

9. Yuanzhou Song⁺,Nana Ma⁺, Xiaohua Ma, Fang Fang, Xuenian Chen,* Yanhui Guo*, Synthesis of Ammonia Borane Nanoparticles and the Diammoniate of Diborane by Direct Combination of Diborane and Ammonia,Chem. Eur. J.,2016,22, 6228.

8. Huizhen Li,⁺Nana Ma,⁺Wenjuan Meng, J. Gallucci, Yongqing Qiu, Shujun Li, Qianyi Zhao, Jie Zhang*, Ji-Cheng Zhao*, Xuenian Chen*, Formation Mechanisms, Structure, Solution Behavior, and Reactivity of Aminodiborane,J. Am Chem. Soc.,2015,137, 12406.

7.Nana Ma, Shujun Li, Likai Yan, Yongqing Qiu*, Zhongmin Su*,Switchable NLO Response Induced byRotation of a Metallacarborane[Ni^III/IV(C₂B₉H₁₁)₂]^-/0,Dalton Trans.,2014,43, 5069.

6.Nana Ma, Chunguang Liu, Yongqing Qiu*, Shiling Sun, Zhongmin Su*,Theoretical Investigation on Redox- Switchable Second-Order Nonlinear Optical Responses of Push–Pull Cp*CoEt₂C₂B₄H₃-Expanded (Metallo)porphyrins,J. Comput. Chem.,2012,33, 211.

5.Nana Ma, Likai Yan, Wei Guan, Yongqing Qiu,* Zhongmin Su,*Theoretical Investigation on Electronic Structure and Second-Order Nonlinear Optical Properties of Novel Hexamolybdate-Organoimido-(Car)borane Hybrid,Phys. Chem. Chem. Phys.,2012,14, 5605.

4.Nana Ma, Shiling Sun, Chunguang Liu, Xiuxin Sun, Yongqing Qiu*, Quantum Chemical Study of Redox-Switchable Second-Order Nonlinear Optical Responses of D-π-A System BNbpy and Metal Pt(II) Chelate Complex,J. Phys. Chem. A,2011,115, 13564.

3.Nana Ma, Guochun Yang, Shiling Sun, Chunguang Liu, Yongqing Qiu*, Computational Study on Second-Order Nonlinear Optical (NLO) Properties of a Novel Class of Two-Dimensional Λ- and W-shaped Sandwich Metallocarborane-Containing Chromophores,J. Organometal. Chem.,2011,696, 2380.

2.Nana Ma, Yongqing Qiu,* Shiling Sun, Chunguang Liu, Min Fan; Zhongmin Su,Theoretical Investigation on Structures, Electronic Spectra and Nonlinear Optical Properties of Gold Compounds [X-{Au(PMe₃)}₂],Sci.ChinaChem.,2010,53, 1149.

1.Nana Ma, Yongqing Qiu,* Shiling Sun, Min Fan; Zhongmin Su, Density Functional Theory Study on Structure and Nonlinear Optical Properties of 13-Vertex Metallacarborane,ACTA CHIMICA SINICA,2010,68, 733.