王涵課題組介紹
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王涵，助理教授、研究員🧝🏿、博導 通訊地址🏅：物質學院8號樓305室 | SPST 8-305 電子郵件🧎🏻♀️➡️：wanghan3@shanghaitech.edu.cn 個人簡歷： 2007-2011 吉林大學, 學士|Jilin University, BS 2011-2017 美國倫斯勒理工, 博士 (導師：Prof. Shengbai Zhang 張繩百教授)|Rensselaer Polytechnic Institute (RPI), PhD 2018-2021 勞倫斯伯克利國家實驗室, 博士後（導師⁉️：Dr. David Prendergast）|Lawrence Berkeley National Laboratory (Berkeley Lab), Postdoc 2021-2022 SUNCAT, SLAC國家加速器實驗室, 助理研究員|SUNCAT Center for Interface Science and Catalysis, SLAC National Accelerator Laboratory, Research Associate 2022- a8体育官网, 助理教授👨🦼➡️、研究員|ShanghaiTech University, Assistant Professor/PI |
本課題組的主要研究方向為開發🛺、應用第一性原理計算方法及機器學習方法研究阿秒 (as)到皮秒(ps)時間尺度的激發態超快動力學過程🤹♂️，建立可以描述分子和固體材料中的電子和原子超快過程的“分子電影”🏓。同時開發X射線光譜的模擬方法，結合X射線自由電子激光裝置的實驗結果🎄🧑🏫，理論研究半導體材料和金屬材料在催化反應、光致相變等物理化學變化中相關的超快過程⚄。 課題組長王涵教授已入選上海市領軍人才項目🚴♂️。 本課題組長期誠聘助理研究員🔻、博士後研究員、碩博連讀研究生。歡迎具有物理、化學、材料等相關專業背景, 對第一性原理計算🆕、材料激發態動力學理論或X射線光譜模擬理論感興趣的學生學者加入！同時也歡迎感興趣的本科生參與到我們的科研工作中來！有意者請郵件聯系wanghan3@shanghaitech.edu.cn。 |
1. H. Wang, J. Bang, Y.Y. Sun, L. Liang, D. West, V. Meunier, and S. Zhang, The role of collective motion in the ultrafast charge transfer in van der Waals heterostructures, Nature Commun. 7, 11504 (2016).
2. H. Wang, M. Odelius, D. Prendergast, A combined multi-reference pump-probe simulation method with application to XUV signatures of ultrafast methyl iodide photodissociation, J. Chem. Phys. 151, 124106 (2019).
3. G. Su*, H. Wang* (共同一作), B. Barnett, J. Long, D. Prendergast, and W. S. Drisdell, Backbonding Contributions to Small Molecule Chemisorption in a Metal–Organic Framework with Open Copper(I) Centers, Chem. Sci. 12, 2156 (2021). (第一理論作者）
4. J. Ma*, H. Wang* (共同一作), S. Nie*, C. Yi, Y. Xu, H. Li, J. Jandke, W. Wulfhekel, Y. Huang, D. West, P. Richard, A. Chikina, V.N. Strocov, J. Mesot, H. Weng, S. Zhang, Y. Shi, T. Qian, M. Shi, and H. Ding, Emergence of nontrivial low‐energy Dirac fermions in antiferromagnetic EuCd2As2, Adv. Mater. 32, 1907565 (2020). (第一理論作者）
5. J. Chai*, Z. Shao*, H. Wang* (共同一作), C. Ming, W. Oh, T. Ye, Y. Zhang, X. Cao, P. Jin, S. Zhang, and Y.Y. Sun, Ultrafast processes in photochromic material YHxOy studied by excited-state density functional theory simulation, Sci. China Mater. 63, 1579 (2020).
6. S. Lei*, H. Wang* (共同一作), L. Huang, Y.Y. Sun, and S. Zhang, Stacking fault enriching the electronic and transport properties of few-layer phosphorenes and black phosphorus, Nano Lett. 16, 1317 (2016).
7. H. Wang, Z. Qiu, W. Xia, C. Ming, Y. Han, L. Cao, J. Lu, P. Zhang, S. Zhang, H. Xu, and Y.Y. Sun, Semimetal or semiconductor: the nature of high intrinsic electrical conductivity in TiS2, J. Phys. Chem. Lett. 10, 6996 (2019).
8. Y. Li*, T. Wang*, H. Wang* (共同一作), Z. Li, Y. Chen, D. West, R. Sankar, R. Ulaganathan, F. Chou, C. Wetzel, C. Xu, S. Zhang, S. Shi, Enhanced light emission from the ridge of two-dimensional InSe flakes, Nano Lett. 18, 5078 (2018). (第一理論作者)
9. M. Guo, X. Liang, H. Wang†(通信作者), and J. Zhang†, Magnetic anisotropy of iridium dimer on two-dimensional materials, Phys. Chem. Chem. Phys. 22, 238 (2020).
10. K. Cheng, M. Wang, S. Wang, N. Liu, J. Xu, H. Wang†(通信作者), and Y. Su†, Monolayer Sc2CF2 as a Potential Selective and Sensitive NO2 Sensor: Insight from First-Principles Calculations, ACS Omega 7, 9267 (2022).
11. H. Ogasawara, H. Wang, J. Gladh, A. Gallo, R. Page, J. Voss, A. Luntz, E. Diesen, F. Abild-Pedersen, A. Nilsson, M. Soldemo, M. Zajac, A. Attar, M. E. Chen, S. W. Cho, A. Katoch, K.-J. Kim, K. H. Kim, M. Kim, S. Kwon, S. H. Park, H. Ribeiro, S. Sainio, H.-Y. Wang, C. Yang, and T. Heinz, X-Ray Free Electron Laser Studies of Electron and Phonon Dynamics of Graphene Adsorbed on Copper, Phys. Rev. Mater. 7, 24005 (2023).
12. C. Ming, H. Wang, D. West, S. Zhang, and Y. Y. Sun, Defect Tolerance in CsPbI3: Reconstruction of the Potential Energy Landscape and Band Degeneracy in Spin-Orbit Coupling, J. Mater. Chem. A 10, 3018 (2022).
13. X. Wu, C. Ming, W. Gao, J. Shi, K. Zhao, H. Wang, and Y. Y. Sun, Effect of Liquidlike Cations on Electronic and Defect Properties of Solid Solutions of Cu2Te and Ag2Te, Phys. Rev. B 105, 1 (2022).
14. J. H. Ma, C. Needham, H. Wang, A. Neureuther, D. Prendergast, and P. Naulleau, Mechanistic Advantages of Organotin Molecular EUV Photoresists, ACS Appl. Mater. Interfaces 14, 5514 (2022).
15. X. Wu, C. Ming, J. Shi, H. Wang, D. West, S. Zhang, and Y.-Y. Sun, Defects in Statically Unstable Solids: The Case for Cubic Perovskite α-CsPbI3, Chinese Phys. Lett. 39, 46101 (2022).
16. K. F. Chang, H. Wang, S. M. Poullain, J. González-Vázquez, L. Bañares, D. Prendergast, D. M. Neumark, and S. R. Leone, Conical Intersection and Coherent Vibrational Dynamics in Alkyl Iodides Captured by Attosecond Transient Absorption Spectroscopy, J. Chem. Phys. 156, 114304 (2022).
17. M. Ge, H. Wang, J. Wu, C. Si, J. Zhang, and S. Zhang, Enhanced Valley Splitting of WSe2 in Twisted van Der Waals WSe2/CrI3 Heterostructures, npj Comput. Mater. 8, 32 (2022).
18. R. Besse, H. Wang, D. West, J. L. F. Da Silva, and S. Zhang, Prediction of Effective Photoelectron and Hole Separation in Type-I MoS2/PtSe2 van der Waals Junction, J. Phys. Chem. Lett. 13, 6407 (2022).
19. K. F. Chang, H. Wang, S. M. Poullain, D. Prendergast, D. M. Neumark, and S. R. Leone, Mapping Wave Packet Bifurcation at a Conical Intersection in CH3I by Attosecond XUV Transient Absorption Spectroscopy, J. Chem. Phys. 154, 234301 (2021).
20. K. Chang, M. Reduzzi, H. Wang, S. Poullain, Y. Kobayashi, L. Barreau, D. Prendergast, D. Neumark, and S. Leone, Revealing electronic state-switching at conical intersections in alkyl iodides by ultrafast XUV transient absorption spectroscopy, Nat. Commun. 11, 4042 (2020).
21. K. Cheng, H. Wang, J. Bang, D. West, J. Zhao and S. Zhang, Carrier Dynamics and Transfer across the CdS/MoS2 Interface upon Optical Excitation, J. Phys. Chem. Lett., 11, 6544 (2020).
22. J. Ma, H. Wang, D. Prendergast, A. Neureuther, and P. Naulleau, Excitation Selectivity in Model Tin-Oxo Resist: A Computational Chemistry Perspective, in Extreme Ultraviolet (EUV) Lithography XI, edited by N. M. Felix and A. Lio, SPIE, 11323, 349–355 (2020).
23. C. Si, D. Choe, W. Xie, H. Wang, Z. Sun, J. Bang, and S. Zhang, Photoinduced vacancy ordering and phase transition in MoTe2, Nano Lett. 19, 3612 (2019).
24. J. Ma, H. Wang, D. Prendergast, A. Neureuther, and P. Naulleau, Investigating EUV radiation chemistry with first principles quantum chemistry calculations. Proc.SPIE 11147, (2019).
25. B.W. Toulson, M. Borgwardt, H. Wang, F. Lackner, A.S. Chatterley, C.D. Pemmaraju, D.M. Neumark, S.R. Leone, D. Prendergast, and O. Gessner, Probing ultrafast C–Br bond fission in the UV photochemistry of bromoform with core-to-valence transient absorption spectroscopy, Struct. Dyn. 6, 54304 (2019).
26. M. Ge, Y. Su, H. Wang, G. Yang, and J. Zhang, Interface depended electronic and magnetic properties of vertical CrI3/WSe2 heterostructures, RSC Adv. 9, 14766 (2019).
27. C. Zhong, Y. Chen, Z.-M. Yu, Y. Xie, H. Wang, S.A. Yang, and S. Zhang, Three-dimensional pentagon carbon with a genesis of emergent fermions, Nature Commun. 8, 15641 (2017).
28. Q. Peng, X. Sun, H. Wang, Y. Yang, X. Wen, C. Huang, S. Liu, and S. De, Theoretical prediction of a graphene-like structure of indium nitride: A promising excellent material for optoelectronics, Appl. Mater. Today 7, 169 (2017).
29. Y. Chen, Y.Y. Sun, H. Wang, D. West, Y. Xie, J. Zhong, V. Meunier, M.L. Cohen, and S. Zhang, Carbon kagome lattice and orbital-frustration-induced metal-insulator transition for optoelectronics, Phys. Rev. Lett. 113, 85501 (2014).
30. D. West, Y.Y. Sun, H. Wang, J. Bang, and S. Zhang, Native defects in second-generation topological insulators: Effect of spin-orbit interaction on Bi2Se3, Phys. Rev. B 86, 121201 (2012).
本組成員 |
| 周坤 碩士研究生 2022級 zhoukun2022@shanghaitech.edu.cn
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| 戴晟 碩士研究生 2022級 daisheng@shanghaitech.edu.cn ———————————— |
| 李靖斌 碩士研究生 2022級 lijb2022@shanghaitech.edu.cn ———————————— |
| 李禎輝 上海應物所訪問博士生 2021級 lizhenhui@sinap.ac.cn ———————————— |
| 王者風 本科生研究助理 2022級 2911544726@qq.com ———————————— |
