个人基本信息

肖蓓蓓，女，1987年生，工学博士/副教授/轮机工程学硕。

研究兴趣主要侧重于燃料电池催化剂的设计与优化以及新能源化学储能过程转变。总发表论文100余篇，总引用次数4000余次，H因子34，第一/通讯作者（含共一/共通）论文34篇，ESI全球1%高引用论文7篇，封面论文2篇，热点论文3篇。

已毕业五届研究生；在读研究生10名。

科研项目

[1]2016-2018 主族元素掺杂Pt基材料催化氧气还原反应的第一原理研究国家自然科学青年基金 主持

[2]2015-2018 Pt系氧气还原反应催化剂的优化设计江苏科技大学基金 主持

[3]2020-2022 国家留学基金委项目国家公派高级研究学者、访问学者、博士后项目 主持

[4]2020-2021 新型固N2电解阴极的设计与机理研究 江苏省研究生科研与实践创新计划项目(杨磊) 指导教师

[5]2020-2022 高性能燃料电池催化剂层的设计与优化 招商局海工科研创新基金项目 主持

[6]2023-2024 五配位CoN₄增强氧还原催化性能的第一性原理研究 江苏省研究生科研与实践创新计划项目(张泽) 指导教师

代表性论文

[1]Xiao, B. B.; Zhu, Y. F.; Lang, X. Y.; Wen, Z.; Jiang, Q., Al₁₃@Pt₄₂ Core-Shell Cluster for Oxygen Reduction Reaction, Sci. Rep. 4, 5205,2014.

[2]Xiao, B. B.; Lang, X. Y.; Jiang, Q., Pt Monatomic Wire Supported on Graphene Nanoribbon for Oxygen Reduction Reaction, RSC Adv. 4, 28400, 2014.

[3]Lang X. Y.⁺; Han, G. F.⁺; Xiao, B. B.+; Gu, L.; Wen, Z.; Zhu, Y. F.; Zhao, M.; Li, J. C. Jiang, Q.,Mesostructured Intermetallic Compounds of Platinum and Non-transition Metals for Enhanced Electrocatalysis of Oxygen Reduction Reaction., Adv. Funct. Mater. 25, 230, 2015.(co-first authors)

[4]Xiao, B. B.; Zhang, P.; Han, L. P.; Wen. Z., Functional MoS₂ by the Co/Ni doping as the catalyst for oxygen reduction reaction., Appl. Surf. Sci. 354, 221, 2015.

[5]Xiao, B. B.; Jiang, X. B.; Jiang, Q., Density Functional Theory Study of Oxygen Reduction Reaction on Pt/Pd₃Al(111) Alloy Electrocatalyst., Phys. Chem. Chem. Phys.18, 14234, 2016

[6] Xiao, B. B.; Jiang, X. B.; Yang, X. L.; Jiang, Q.; Zheng, F. The segregation resistance of the sandwich Pt_2ML/Os/Pd₃Al catalyst for oxygen reduction reaction: A Density Functional Theory Study. Phys. Chem. Chem. Phys.18, 30174, 2016

[7] Xiao, B. B.; Liu, H. Y.; Jiang, X. B.; Yu, Z. D.; Jiang, Q.A BifunctionalTwo Dimensional TM₃(HHTP)₂ monolayer and its variations for Oxygen Electrode Reactions.RSC Adv. 7, 54332, 2017.

[8]Xiao, B. B.; Zhu, H.; Liu, H. Y.; Jiang, X. B.; Jiang, Q. The Activity Improvement of the TM₃(hexaiminotriphenylene)₂ Monolayer for Oxygen Reduction Electrocatalysis: A Density Functional Theory Study.Front. Chem. 6, 351, 2018.

[9]Zhu, H.; Liu, H. Y.; Yang, L.; Xiao, B. B.* How to boost the activity of the monolayer Pt supported on TiC catalyts for oxygen reduction reaction: A Density Functional Theory Study. Mater.12, 1560, 2019

[10] Han, Gao-Feng; Xiao, Bei-Bei^*; Kim, Seok-Jin; Li, Feng; Ahmad, Ishfaq; Jeon, In-Yup; Baek, Jong-Beom^*, Tuning edge-oxygenated groups on graphitic carbon materials against corrosion. Nano Energy 66, 104112, 2019 (co-corresponding authors)

[11] Xiao, B. B.; Liu, H. Y.; Yang, L.; Song, E. H.; Jiang, X. B.; Jiang, Q. Design effective graphene with TM/O moiety for the oxygen electrode reaction. ACS Appl. Energy Mater. 3, 260, 2020

[12] Xiao, B. B.; Yang, L.; Yu, L. B.; Song, E. H.; Jiang, Q. The VN₃ embedded graphane with improved selectivity for nitrogen fixation. Appl. Surf. Sci. 513, 145855, 2020.

[13] Yang, L.; Chen, F. X.; Song, E. H.; Yuan, Z. F.; Xiao, B. B.* Feasibility of N₂ reduction on the V anchored 1T-MoS₂ monolayer: a density functional theory study. ChemPhysChem 21, 1235-1242, 2020. (Front Cover: 21, 1215-1215, 2020; Cover Feature: 21, 1217-1217, 2020)

[14] Wenwu Zhong,* Wenguang Tu*, Zongpeng Wang, Zhiping Lin, Aijiao Xu, Xiufang Ye, Dongchu Chen, Beibei Xiao*, Ultralow-temperature assisted synthesis of single platinum atoms anchored on carbon nanotubes for efficiently electrocatalytic acidic hydrogen evolution. J. Energ. Chem. 51, 280-284, 2020.  high-cited, hot paper

[15] Zongpeng Wang^†, Beibei Xiao^†, Zhiping Lin, Shijie Shen, Aijiao Xu, Yuchao Chen, Wenwu Zhong*, In-situ surface decoration of RuO₂ nanoparticles by laser ablation for improved oxygen evolution reaction activity in both acid and alkali solutions. J. Energ. Chem. 54, 510-518, 2020. (co-first authors) high-cited

[16] Shuang Wang^{a, †}, Beibei Xiao^{b, †}, Shijie Shen^a,*, Kai Song^a, Zhiping Lin^a, Zongpeng Wang^a, Yuchao Chen^a, Wenwu Zhong^a,*, Cobalt doping of FePS₃ promotes intrinsic active sites for efficient hydrogen evolution reaction. Nanoscale 12, 14459-14464, 2020. (co-first authors)

[17] L. Yang, L. B. Yu, S. S. Liu, E. H. Song, Y. D. Song, Xiao, B. B*. The FeN₃ Doped Fluorographene for N₂ Fixation: A Density Functional Theory Study. ChemistrySelect. 2020.

[18] Xiao, B. B.; Yang, L.; Liu, H. Y.; Jiang, X. B.; Kochetov, V.; Song, E. H.; Jiang, Q. Designing Fluorographene with FeN₄ and CoN₄ Moieties for Oxygen Electrode Reaction: A Density Functional Theory Study. Appl. Surf. Sci. 2021, 537, 147846.

[19]Wenwu Zhong^†, Beibei Xiao^†, Zhiping Lin, Zongpeng Wang, Liangai Huang, Shijie Shen, Qinghua Zhang and Lin Gu, RhSe₂: a superior 3D electrocatalyst with multiple active facets for hydrogen evolution reaction in both acid and alkaline solutions. Adv. Mater. 2021, 2007894.(co-first authors) high-cited, hot paper

[20] Zhiping Lin^†, BeiBei Xiao^†, Zongpeng Wang, Shijie Shen, Liangai Huang, Jitang Zhang, Fanqi Meng, Qinghua Zhang, Lin Gu, and Wenwu Zhong, anar-coordination PdSe₂ nanosheets as highly active electrocatalyst for hydrogen evolution reaction. Adv. Funct. Mater.2021, 2102321(co-first authors) high-cited

[21] L. Yang, F. X. Chen, M. Wu, E. H. Song, B. B. Xiao*, Q. Jiang*, N₂ fixation via Mo decroated zigzag of graphene nanoribbon. Appl. Surf. Sci.2021, 568, 150867.

[22] Zongpeng Wang^1,+, Beibei Xiao^2,+, Zhiping Lin¹, Yaping Xu¹, Yan Lin¹, Fanqi Meng³, Qinghua Zhang³, Lin Gu³, Baizeng Fang⁴, Shaojun Guo⁵ and Wenwu Zhong^1,*, PtSe₂/Pt heterointerface with reduced coordinate for boosted hydrogen evolution reaction. Angew. Chem. Int. Ed., 2021,60, 23388 (co-first authors) high-cited

[23] Liu, S. S.; Huang, Q. Y.; Wang, L. L.; Song, E. H.; Xiao, B. B*. Boosting Hydrogen Evolution Activity of Transition Meta-Nitrogen embedded Graphene through Introducing Secondary Transition Metal. Surf. Inter., 2022, 29, 101714

[24] L. B. Yu, Q. Y. Huang, J. Wu, E. H. Song, B. B. Xiao*, Spatial-five coordination promotes the high efficiency of CoN₄ moiety in graphene-based bilayer for oxygen reduction electrocatalysis: A density functional theory study, Chinese Journal of Chemical Engineering, 2022

[25] B. B. Xiao*; Q. Y. Huang.; J. Wu.; E. H. Song; Q. Jiang*, Tetragonal Transition Metal Selenide for Hydrogen Evolution. Appl. Surf. Sci. 2022, 591, 153249

[26] Wu Jing, Yu Libing, Liu Shuaishuai, Huang Qiuyan, Jiang Shanshan, Anton Matveev, Wang, Lianli, Song Erhong*, Xiao Beibei*, The NiN₄/Cr embedded graphene for electrochemical nitrogen fixation, J. Inorg. Mater., 2022, 37, 1141.

[27] Zhiping Lin, BeiBei Xiao, Min Huang, Linghui Yan, Zongpeng Wang, Yucong Huang, Shijie Shen, Qinghua Zhang, Lin Gu, Wenwu Zhong*, Realizing negatively charged metal atoms through controllable d-electron transfer in ternary Ir_1-xRh_xSb intermetallic alloy for hydrogen evolution reaction. Adv. Energy Mater. 2022, 2200855 (co-first authors) (Back Cover: 12, 25, 2270108) high-cited

[28] Wu, J.; Yang, L; Liu, X.; Xiao, B. B.*; Ao, Z. M.*, Transition metal heteroatom decorated bismuthene catalyst for ammonia synthesis: A density functional theory study. Chin. Chem. Lett. 2022.

[29] B. B. Xiao*, Z. Zhang, L. B. Yu, S. S. Liu, J. Wu, Q. Y. Huang, E. H. Song, L. L. Wang, Boosting Oxygen Reduction Electrocatalysis of Graphene-Based Bilayer Heterojunction, Surf. Inter., 2022, 33, 102232

[30] Q. Y. Huang.; X. Liu, J. Wu.; B. B. Xiao*; Z. M. Ao*, Dopant-Vacancy Activiated Tetragonal Transition Metal Selenide for Improved Hydrogen Evolution. Chin. Chem. Lett. 2022

[31] J. Wu; L. Yang; X. Liu; Z. Zhang; S. P. Liu; B. B. Xiao*, ZrN₆-doped graphene for ammonia synthesis: A density functional theory study.ChemPhysChem 2023, 24, e202200864

[32] Lei, Yang; Jiake Fan; Bei-Bei Xiao*; Weihua Zhu*, Unveiling “Sabatier principle” for electrocatalytic nitric oxide reduction on singlecluster catalysts: A DFT and machine learning guideline, Chem. Eng. J., 2023, 468, 143823