易文才副教授

发布时间:2021-12-07文章来源: 浏览次数:

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办公地址:曲阜师范大学实验楼C104室

电子邮件:yiwc@qfnu.edu.cn

个人主页:https://www.researchgate.net/profile/Wencai_Yi

 

教育背景

2013.09-2018.06 吉林大学理论化学研究所 理学博士 导师:刘靖尧教授

2016.12-2017.12 California State University 访问学者 导师:苗茂生教授

2009.09-2013.07 天津师范大学化学院 理学学士 导师:杨华教授

 

工作经历

2021年01月-至今 曲阜师范大学开元娱乐app官网 副教授

2018年07月-2020年12月 曲阜师范大学开元娱乐app官网 讲师

 

教学任务

主要承担理工科本科生大学物理、大学物理实验以及近代物理实验等相关教学工作。

 

研究兴趣

采用第一性原理计算和结构搜索算法,探究低维材料微观晶体结构和电子结构性质。通过结构搜索,挖掘材料微观结构与宏观性质之间的关系,并基于此设计新型低维多功能材料。目前已在J. Mater. Chem. A, J. Phys. Chem. Lett, J. Mater. Chem. C,Appl. Surf. Sci.等期刊发表SCI论文60余篇,软件著作权3项,h因子16。研究兴趣包含:

1. 含能材料(叠氮化合物)微观晶体结构探究。

2. 新型低维亚稳气敏材料微观结构及稳定性的理论探究;

3. 低维功能材料催化性能及催化反应微观机理的理论研究;

4. 新型低维孔材料结构搜索算法的开发。

 

科研项目

[1] 国家自然科学青年科学基金项目 《五唑阴离子金属高能化合物常压晶体结构及稳定性的第一性原理研究》  2020年01月—2022年12月 项目编号:21905159 主持;

[2] 山东省自然科学博士基金 《基于掺杂提高磷烯结构稳定性及气敏性质的理论研究》 2019年07月—2022年06月 项目编号:ZR2019BA010 主持;

[3] 国家自然科学基金面上项目 《石墨烯等双层转角系统中莫尔势对电子结构和电子关联效应调制的理论》  2020年01月—2023年12月 项目编号:11974207 参与;

[4] 山东省自然科学基金面上项目 《利用高温高压技术对金刚石内 NV 中心的可控制备及调控机制研究》 2019年07月—2022年06月 项目编号:ZR2019MA054 参与

 


软件著作权

[1] VASP快速使用辅助软件(简称qvasp,原始取得) 2018年12月19日 登记号:2019SR0363124 (商用请联系授权)

[2] 二维孔材料结构搜索软件(简称CHERRY,原始取得) 2021年04月22日 登记号:2021SR0578533

[3] 气敏传感器和催化剂自动筛选软件(简称GSASP,原始取得) 2021年12月02日 登记号:2021SR1970864

 

代表性论文

2021-Now

1. Yi W. C.*, Jiang X. G., Wang Z. X., Yang T., Yang B. C.  and Liu X. B.*, ABX6 Monolayers: A New Dirac Material Family Containing High Fermi Velocities and Topological Properties, Appl. Surf. Sci., 2021, 570: 151237.

2. Jiang X., Yang T., Fei G., Yi W. C.* and Liu X. B.*. Novel Two-Dimensional ABX3 Dirac Materials: Achieving a High-Speed Strain Sensor via a Self-Doping Effect, J. Phys. Chem. Lett., 2022, 13, 2,676–685.

3. Yang T., Jiang X., Yi W. C.*, Cheng X. M.*, Cheng T. X.*, Enhanced Fast Response to Hg0 by Adsorption-Induced Electronic Structure Evolution of Ti2C Nanosheet, Appl. Surf. Sci., 2021, 544, 148925.

4. Lu H. Y.*, Jiao N., Li B. W., Yi W. C.*,  Zhang P.*, Hydrogenated Group IV-V monolayer HAB6: A New Type of Dirac Material Constructed by Isoelectronic Rule, Appl. Surf. Sci., 2021, 554: 149635.

5. Yang T., Jiang X. G., Yi W. C.*, Cheng X. M.*,  Liu X. B., A g-SiC6 monolayer and its analogs: A new class of tunable dirac cone materials and novel quantum spin hall insulators, Appl. Surf. Sci., 2022, 578:  151986.

6. Zhang Z., Du H. Y.*, Yi W. C.*,  Sun Y., Zheng Y., Wu Y., Xu S. Investigation of Ammonia-sensing Mechanism on Polypyrrole Gas Sensor Based on Experimental and Theoretical Evidence. Sensor. Mater., 2021, 33(4), 1443-1454.

7. Cui Y. F., Duan S., Chen X.*, Yang M. M., Yang B. C., Yi W. C.*,  Liu X. B., Prediction of enhanced thermoelectric performance in two-dimensional black phosphorus nanosheets, Vaccum, 2021, 183: 109790.

8. Qi W, Yi W. C. (共一), Jiang W, et al. Interfacial Assembled CeO2–x/Co@ N-Doped Carbon Hollow Nanohybrids for High-Performance Lithium–Sulfur Batteries. ACS Sustain. Chem. Eng., 2021, 9, 43, 14451–14460.

9. Guan H. M., Li T., Han J., Yi W. C., Bai H., Xi G. C. General low-temperature molten-salt route to three-dimensional porous metallic transition metal nitrides as highly sensitive and extremely stable surface enhanced Raman scattering substrates, Nat. Commun., 2021, 12(1), 1-11.

10. Liu D, Song X, Yi W. C., et al. General Microwave Route to Single-Crystal Porous Transition Metal Nitrides for Highly Sensitive and Stable Raman Scattering Substrates. Nano Lett., 2021, 21, 18, 7724–7731.

11. Song X, Yi W. C., Li J, et al. Selective Preparation of Mo2N and MoN with High Surface Area for Flexible SERS Sensing. Nano Lett., 2021. 21, 10, 4410–4414.

12. Dong T, Yi W. C., Deng T, et al. Diffusionless‐like Transformation Unlocks Pseudocapacitance with Bulk Utilization: Reinventing Fe2O3 in Alkaline Electrolyte. Energy Environ. Mater., 2021, DOI:10.1002/eem2.12262.

13. Li J. B., Yi W. C., Yin M., Yang H. F., Li J. F., Li Y. H., Jiao Z.W., Bai H., Zou M.Q. and Xi G. C.*. Plasmonic Rare-Earth Nanosheets as Surface Enhanced Raman Scattering Substrates with High Sensitivity and Stability for Multicomponent Analysis. ACS Nano, 2022, DOI: 10.1021/acsnano.1c08961.

14. Li J, Yi W. C., Li Y, et al. Nitrogen-Doped Titanium Monoxide Flexible Membrane for a Low-Cost, Biocompatible, and Durable Raman Scattering Substrate. Anal. Chem. 2021, 93(37): 12776-12785.

15. Duan S, Cui Y, Yi W. C.,  Chen X.*, Liu X. B.*, et al. Superior Conversion Efficiency Achieved in GeP3/h-BN Heterostructures as Novel Flexible and Ultralight Thermoelectrics. ACS Appl. Mater. Inter. 2021, 13(16): 18800-18808.


2019-2020

1. Yi W. C.,Zhao L., Chen X., Liu X.B., Zheng Y. H. and Miao Maosheng.* Packing high-energy together: Binding the power of pentazolate and high-valence metals with strong bonds. Mater. Des.. 2020, 193, 108820.

2. Yi W. C.*, Tang G.*, Chen X., Yang B. C., Liu X. B.*, qvasp: A Flexible Toolkit for VASP Users in Materials Simulations, Comput. Phys. Commun.,  2020, 257, 107535.

3. Yi W. C.*,Chen X., Wang Z. X.,Yang B. C. and Liu X. B.* A novel two-dimensional δ-InP3 monolayer with high stability, tunable bandgap, high carrier mobility, and gas sensing of NO2. J. Mater. Chem. C.2019,7, 7352-7359.

4. Yi, W. C.*, Zhao K, Wang Z, et al. Stabilization of the High-Energy-Density CuN5 Salts under Ambient Conditions by a Ligand Effect. ACS Omega, 2020,5(11), 6221-6227.

5. Yi W. C.*,  Jiang X. G., Yang T., Yang B. C., Liu Zhen* and Liu X. B.*, Crystalline Structures and Energetic Properties of Lithium Pentazolate under Ambient Conditions. ACS Omega, 2020, 5, 38, 24946–24953.

6. Du H. Y.*, Yang W., Yi W. C.*, Sun Y. H., Yu N. S., Wang J. Oxygen-plasma-assisted Enhanced Acetone-sensing Properties of ZnO Nanofibers by Electrospinning, ACS Appl. Mater. Inter., 2020, 12, 20, 23084–23093.

7. Fei G., Duan S., Zhang M., Ren, Z., Cui, Y., Chen, X.*, Liu, Y., Yi W. C.*, Liu, X. B.*, Predicted stable Li5P2 and Li4P at ambient pressure: novel high-performance anodes for lithium-ion batteries, Phys. Chem. Chem. Phys., 2020, 22(34), 19172-19177.

8. Wang Z. X., Yang, T., Yang B. C., Yi W. C.*, Prediction of stable energetic beryllium pentazolate salt under ambient conditions, Crystengcomm, 2020, 22(36), 6057-6062.

9. Ye Y,Yi W. C., (共一) Liu W.,Zhou Y., Xi G. C.* et al. Remarkable Surface-Enhanced Raman Scattering of Highly Crystalline Monolayer Ti3C2 Nanosheets. Sci. China Mater., 2020, 63(5), 794-805.

10. Guan H. M.,  Yi W. C.,  Li T.,  Li Y. H.,  Li J. F.,  Bai H., Xi G. C.*. Low temperature synthesis of plasmonic molybdenum nitride nanosheets for surface enhanced Raman scattering. Nat. Commun., 2020, 11, 3889.

11. Du R. F., Yi W. C.,  Li W. T., Yang H. F., Bai H., Xi G. C.*, Quasi-Metal Microwave Route to MoN and Mo2C Ultrafine Nanocrystalline Hollow Spheres as Surface Enhanced Raman Scattering Substrates, ACS Nano, 2020, 14, 10, 13718–13726. 

12. Chen X.*, Duan S., Yi W. C., Singh D. J., Guo J. G.* and Liu X. B.*, Enhanced thermoelectric performance in black phosphorus nanotubes by band modulation through tailoring nanotube chirality, Small, 2020, 16(28), 2001820.

13. Duan S., Cui Y., Chen X., Yi W. C., Liu Y. X. and Liu X.B. Ultrahigh Thermoelectric Performance Realized in Black Phosphorus System by Favorable Band Engineering through Group VA Doping. Adv. Funct. Mater., 2019, 1904346.

14.Li Y, Bai H, Zhai J, Yi W. C., et al. Alternative to noble metal substrates: Metallic and plasmonic Ti3O5 hierarchical microspheres for surface enhanced Raman spectroscopy. Anal. Chem., 2019, 91(7): 4496-4503. 

15. Hu L, Yi W. C., Rao T, et al. Two-dimensional type-II gC3N4/SiP–GaS heterojunctions as water splitting photocatalysts: first-principles predictions. Phys. Chem. Chem. Phys., 2020, 22(27): 15649-15657


2013-2019

1. Yi W. C.; Liu W.; Botana J.; Liu J. Y.; Miao M. S., Microporosity as a new property control factor in graphene-like 2D allotropes. J. Mater. Chem. A 2018, 6(22), 10348-10353.

2. Yi W. C.; Liu W.; Botana J.; Zhao L.; Liu Z.; Liu J. Y.; Miao M. S., Honeycomb Boron Allotropes with Dirac Cones: A True Analogue to Graphene. J. Phys. Chem. Lett. 2017, 8 (12), 2647-2653.

3.Yi W. C.; Hu T.; Su T.; Islam R.; Liu J. Y.; Miao M. S., A CNH monolayer: a direct gap 2D semiconductor with anisotropic electronic and optical properties. J. Mater. Chem. C 2017, 5 (33), 8498-8503

4. Yi W. C.; Liu W.; Zhao L.; Islam R.; Miao M. S.; Liu J. Y., Asymmetric passivation of edges: a route to make magnetic graphene nanoribbons. RSC Adv. 2017, 7 (45), 27932-27937.

5. Zhao L., Yi W. C. ;(共一) Botana J.; Gu F. L.; Miao M. S., Nitrophosphorene: A 2D Semiconductor with Both Large Direct Gap and Superior Mobility. J. Phys. Chem. C. 2017, 121(21), 28520–28526

6. Bai H.; Yi W. C.; Li J.; Xi G. C.*; Li Y.; Yang H.; Liu J. Y., Direct growth of defect-rich MoO3-xultrathin nanobelts for efficiently catalyzed conversion of isopropyl alcohol to propylene under visible light. J. Mater. Chem. A 2016, 4 (5), 1566-1571.

7. Bai H.; Yi W. C.; Liu J. Y.; Lv Q.; Zhang Q.; Ma Q.; Yang H.; Xi G. C.*, Large-scale synthesis of ultrathin tungsten oxide nanowire networks: an efficient catalyst for aerobic oxidation of toluene to benzaldehyde under visible light. Nanoscale 2016, 8 (28), 13545-51.

8. Zhang Q.; Li X.; Ma Q.; Zhang Q.; Bai H.; Yi W. C.; Liu J. Y.; Han J.; Xi G. C.*, A metallic molybdenum dioxide with high stability for surface enhanced Raman spectroscopy. Nat. Commun. 2017, 8, 14903.

9. Bai H., Liu W., Yi W. C., Li X., Zhai J., Li J., Xi G. C.*,  Metallic carbide nanoparticles as stable and reusable substrates for sensitive surface-enhanced Raman spectroscopy. Chem. Commun., 2018. 54(77), 10843-10846.

10. Li J, Bai H, Yi W. C., et al. Synthesis and facet-dependent photocatalytic activity of strontium titanate polyhedron nanocrystals. Nano Res., 2016, 9(5): 1523-1531.

11. He C, Bai H, Yi W. C., et al. A highly sensitive and stable SERS substrate using hybrid tungsten dioxide/carbon ultrathin nanowire beams. J. Mater. Chem. C, 2018, 6(13): 3200-3205.

12. Zhang Q., Li X., Yi W. C., Li W., Bai H., Liu J., Xi, G. C.*,. Plasmonic MoO2 nanospheres as a highly sensitive and stable non-noble metal substrate for multicomponent surface-enhanced Raman analysis. Anal. Chem., 89(21), 11765-11771.

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