Jilai Li   

Title:Professor
Supervisor of Doctorate Candidates
Supervisor of Master's Candidates

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Language:English

Biography

李吉来 博士,教授,山东大学青岛理论与计算科学研究院

男,19776月生。2007年于吉林大学获博士学位。2009年至2016年任吉林大学副教授,2012年至2022年任吉林大学博士生导师,2016年至2022年任吉林大学化学学院教授。2011年至2013年瑞典隆德大学博士后,2013年至2020年德国柏林工业大学访问学者。2022年获聘山东大学杰出中青年学者(第一层次)。

研究方向

        [1] 化学微观过程及反应控制规律

        [2] 量子化学、密度泛函理论方法适用性

学术成绩

迄今为止发表SCI论文近百篇,其中以第一/通讯作者发表化学类顶刊(包括但不限于)2Proc. Natl. Acad. Sci.6J. Am. Chem. Soc.8Angew. Chem. Int. Ed.。作为合作者发表1J. Am. Chem. Soc.9Angew. Chem. Int. Ed.1Acc. Chem. Res.。十余篇论文入选杂志的封面、扉页、VIP和热点文章。2017年入选吉林大学国家杰出青年培育计划,2018年获吉林省自然科学学术成果奖。主持国家自然科学基金委重大研究计划培育、面上项目等4项,中石化横向课题1项,参与科技部重大项目(973)子课题一项

奖励

        [1]    吉林省自然科学学术成果奖––2018

基金

[1]  山大杰青李吉来学科建设经费,2023-2028,主持(200万)

[2]     VOC中低碳烃氧化燃烧及脱氢催化剂的研制,中国石油化工股份有限公司,2022.01-2023.12,主持 (100)

[3]     仿生原子团簇协同催化甲烷和氮气活化,国家自然科学基金重大研究计划培育(92161120)2022.01-2024.12,主持(直接经费75)

[4]     甲烷氢转移机制研究和单原子催化剂理性设计,国家自然科学基金面上项目(21773085)2018.01-2021.12,主持 (直接经费65)

[5]     吉林大学国家杰青培育计划,2017-2018,主持 (20)

[6]     一碳分子活化机制研究和全新催化剂设计,国家自然科学基金面上项目(21473070)2015.01-2018.12,主持 (88)

[7]     高比能直接甲醇燃料电池关键纳米技术与纳米结构研究有序纳米结构膜电极的可控构筑及界面演化机制,国家重点基础研究发展计划(2012CB932800)2012.01-2016.08,参与 (3000)

[8]     高价氧络铁催化碳-氢键活化反应的理论研究,国家自然科学基金青年基金(21103064)2012.01-2014.12,主持 (25)

仪器设备

        [1] 沃特世环形离子淌度超高分辨液质联用仪 Select Series Cyclic IMS

        [2] 沃特世超高效液相色谱仪 Acquity UPLC I-class Plus

        [3] 布鲁克傅立叶变换红外光谱仪INVENIO S

        [4] 安捷伦气相色谱8890和8860

        [5] 自研固定床催化反应评价装置


论文列表

1Acc. Chem. Res., 2Proc. Natl. Acad. Sci. USA, 8J. Am. Chem. Soc., 17 Angew. Chem. Int. Ed., 2J. Chem. Theory Comput., 9Chem. Eur. J., 1 ACS Appl. Mater. Interfaces

            [1]        Jilai Li*, Caiyun Geng, Thomas Weiske, Mingfei Zhou*, Jun Li*, Helmut Schwarz* 

Revisiting the Intriguing Electronic Features of the BeOBeC Carbyne and Some Isomers: A Quantum-Chemical Assessment

Angew. Chem. Int. Ed. 2020, 59, 17261–17265. DOI: 10.1002/anie.202007990

            [2]        Jilai Li*, Caiyun Geng, Thomas Weiske, Helmut Schwarz*

On the Crucial Role of Isolated Electronic States in the Thermal Reaction of ReC+ with Dihydrogen

Angew. Chem. Int. Ed. 2020, 59, 9370-9376. DOI: 10.1002/anie.202001599

Selected as HOT Paper 

            [3]        Jilai Li*, Caiyun Geng, Thomas Weiske, Helmut Schwarz*

Counter-intuitive Gas-phase Reactivities of [V2]+ and [V2O]+ towards CO2 Reduction: Insight from Electronic Structure Calculations

Angew. Chem. Int. Ed. 2020, 59, 12308-12314. DOI: 10.1002/anie.202001223

Highlighted as the Frontispiece article 

            [4]        Zhiliang Chen, Xiaojie Liu, Chuixiu Huang*, Jilai Li* and Xiantao Shen*

Artificial Cytochrome c Mimics: Graphene Oxide-Fe(III) Complex Coated Molecularly Imprinted Colloidosomes for Selective Photoreduction of Highly Toxic Pollutants

ACS Appl. Mater. Interfaces 2020, 12, 6615-6626. DOI: 10.1021/acsami.9b19186 

            [5]        Caiyun Geng, Jilai Li*, Thomas Weiske, Helmut Schwarz*

Complete Cleavage of the NN Triple Bond by Ta2N+ via Degenerate Ligand Exchange at Ambient Temperature: A Perfect Catalytic Cycle

Proc. Natl. Acad. Sci. USA 2019, 116, 21416–21420. DOI: 10.1073/pnas.1913664116

            [6]        Caiyun Geng, Jilai Li*, Thomas Weiske, Helmut Schwarz*

A Reaction-Induced Localization of Spin Density Enables Thermal C–H Bond Activation of Methane by Pristine FeC4+

Chem. Eur. J. 2019, 25, 12940–12945. DOI: 10.1002/chem.201902572

Inside Cover Chem. Eur. J. 2019, 25, 12852 DOI: 10.1002/chem.201903217

            [7]        Caiyun Geng, Thomas Weiske, Jilai Li*, Sason Shaik*, Helmut Schwarz*

Intrinsic Reactivity of Diatomic 3d Transition-Metal Carbides in the Thermal Activation of Methane: Striking Electronic Structure Effects

J. Am. Chem. Soc. 2019, 141, 599-610. DOI: 10.1021/jacs.8b11739

            [8]        Caiyun Geng, Jilai Li*, Thomas Weiske, Helmut Schwarz*

Ta2+ Mediated Ammonia Synthesis from N2 and H2 at Ambient Temperature

Proc. Natl. Acad. Sci. USA 2018, 115, 11680-11687. DOI: 10.1073/pnas.1814610115

            [9]        Caiyun Geng, Jilai Li*, Thomas Weiske, Helmut Schwarz*

Thermal O–H Bond Activation of Water as Mediated by Heteronuclear [Al2Mg2O5]+: Evidence for Oxygen-Atom Scrambling

J. Am. Chem. Soc. 2018, 140, 9275-9281. DOI: 10.1021/jacs.8b05618

            [10]      Helmut Schwarz*, Sason Shaik*, Jilai Li*

Electronic Effects on Room-Temperature, Gas-Phase CH Bond Activations by Cluster Oxides and Metal Carbides: The Methane Challenge

J. Am. Chem. Soc. 2017, 139, 17201–17212. DOI: 10.1021/jacs.7b10139

[11]      Lei Yue, Jilai Li*, Shaodong Zhou, Xiaoyan Sun, Maria Schlangen, Sason Shaik*, Helmut Schwarz*

Control of Product Distribution and Mechanism by Ligation and Electric Field in the Thermal Methane Activation

Angew. Chem. Int. Ed. 2017, 56, 10219–10223. DOI: 10.1002/anie.201703485

Selected as Very Important Paper & Back Cover

[12]      Caiyun Geng, Jilai Li*, Thomas Weiske, Maria Schlangen, Sason Shaik*, Helmut Schwarz*

Electrostatic and Charge-Induced Methane Activation by a Concerted Double C–H Bond Insertion

J. Am. Chem. Soc. 2017, 139, 1684–1689. DOI: 10.1021/jacs.6b12514

            [13]      Jilai Li, Shaodong Zhou, Maria Schlangen, Thomas Weiske, Helmut Schwarz*

Hidden Hydride Transfer as a Decisive Mechanistic Step in the Reactions of the Unligated Gold Carbide [AuC]with Methane Under Ambient Conditions

Angew. Chem. Int. Ed. 2016, 55, 13072–13075. DOI: 10.1002/anie.201606707.

[14]      Jilai Li, Shaodong Zhou, Jun Zhang, Maria Schlangen, Dandamudi Usharani, Sason Shaik, Helmut Schwarz*

Mechanistic Variants in Gas-phase Metal-oxide Mediated Activation of Methane at Ambient Conditions

J. Am. Chem. Soc. 2016, 138, 11368–11377. DOI: 10.1021/jacs.1026b07246

Spotlighted, DOI: 10.1021/jacs.1026b09412

[15]      Jilai Li, Shaodong Zhou, Jun Zhang, Maria Schlangen, Thomas Weiske, Dandamudi Usharani, Sason Shaik*, Helmut Schwarz*

Electronic Origins of the Variable Efficiency of Room-Temperature Methane Activation by Homo- and Heteronuclear Cluster Oxide Cations [XYO2]+ (X, Y = Al, Si, Mg): Competition between Proton-Coupled Electron Transfer versus Hydrogen-Atom Transfer

J. Am. Chem. Soc. 2016, 138, 7973–7981. DOI: 10.1021/jacs.6b03798

            [16]      Jilai Li, Shaodong Zhou, Xiao-Nan Wu, Shiya Tang, Maria Schlangen, Helmut Schwarz*

On the Mechanisms of Hydrogen-Atom Transfer from Water to the Heteronuclear Oxide Cluster [Ga2Mg2O5]+: Remarkable Electronic Structure Effects

Angew. Chem. Int. Ed. 2015, 54, 11861–11864. DOI: 10.1002/anie.201505336

            [17]      Jilai Li, Xiao-Nan Wu, Shaodong Zhou, Shiya Tang, Maria Schlangen, Helmut Schwarz*

Distinct Mechanistic Differences in the Hydrogen-Atom Transfer from Methane and Water by the Heteronuclear Oxide Cluster [Ga2MgO4]

Angew. Chem. Int. Ed. 2015, 54, 12298–12302. DOI: 10.1002/anie.201584261

Highlighted as frontispiece article

[18]      Jilai Li, Xiao-Nan Wu, Maria Schlangen, Shaodong Zhou, Patricio González-Navarrete, Shiya Tang, Helmut Schwarz*

On the Role of the Electronic Structure of the Heteronuclear Oxide Cluster [Ga2Mg2O5]+ in the Thermal Activation of Methane and Ethane: An Unusual Doping Effect

Angew. Chem. Int. Ed. 2015, 54, 5074-5078. DOI: 10.1002/anie.201412441

Selected as VIP 


Education

  • 1998.9-2002.6  

    曲阜师范大学       化学教育       Bachelor's Degree in Science

  • 2002.9-2007.6  

    吉林大学       物理化学       Doctoral Degree in Science

Professional Experience

  • 2013.04-2020.10

    德国柏林工业大学

  • 2011.06-2013.03

    德国隆德大学

  • 2007.07-2009.09

    山东大学

  • 2009.09-2022.11

    吉林大学

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