苏培峰

个人简历：
beat365正版唯一官网理学学士（2001年6月）；
beat365正版唯一官网理学博士（2007年12月）；
美国明尼苏达大学化学系访问学者（2006年11月-2007年1月）
美国内布拉斯加大学化学系博士后（2008年2月-2009年10月）
2015年度福建省自然科学奖一等奖，第三完成人.
福建省2017年度新世纪优秀人才支持

研究兴趣：
1. 分子相互作用理论方法、计算程序发展与应用 2. 化学键理论方法、程序与应用

近期主要代表论著：

  https://www.researchgate.net/profile/Peifeng-Su/research

1. 1. Zhang, Y.; Wang, W.; Lasorne, B.;* Su, P.;* Wu, W. Diabatization around Conical Intersections with a New Phase-Corrected Valence-Bond-Based Compression Approach, J. Phys. Chem. Lett. 2021 12, 7, 1885,

2. 2. Zheng, P.; Ji, C.; Yang, F.; Su, P.;* Wu, W.* A Valence-Bond-Based Multiconfigurational Density Functional Theory: The λ-DFVB Method Revisited. Molecules 2021, 26, 521

3. 3. Su, T.; Tang, Z.; Yin, C.; Yang, Y.; Wang, H.; Peng, L.; Su, Y.; Su, P.;* Li, J.* Insights into      quaternary ammonium-based ionic liquids series with tetrafluoroborate      anion for CO2 capture. J. Mol. Liq. 2021, 327:114857

4. 4. Wang, Y.; Su, P.* Why Can Cationic Halogen Bond Donors      Activate the Ritter-Type Solvolysis of Benzhydryl Bromide but Cationic      Hydrogen Bond Donors Can Not? ACS Omega 2020, 5, 21862.

5. 5. Zhang, Y.; Su, P.;* Lasorne, B.;* Braïda, B.; and Wu, W. A      Novel Valence-Bond-Based Automatic Diabatization Method by Compression, J.      Phys. Chem. Lett. 2020, 11, 5295.

6. 6. Su, P.*;      Tang, Z.; Wu, W.* Generalized Kohn-Sham energy decomposition analysis and      its applications, WIREs. Comput. Mol. Sci. 2020; e1460.

7. 7. Tang, Z.; Jiang, Z.; Chen, H.; Su, P.*; Wu, W. Energy decomposition      analysis based on broken symmetry unrestricted density functional theory,      J. Chem. Phys. 2019, 151, 244106.

8. 8. Ying, F.; Zhou, C.; Zheng, P.; Luan, J.; Su, P.*; Wu, W. l-density      functional valence bond: a valence bond-based multiconfigurational density      functional theory with a single variable hybrid parameter, Front. Chem.      2019, 7, 225.

9. 9. Li, M.; Zhang, H.; Gao, F.; Tang, Z.; Zeng, D.; Pan, Y.; Su, P.*;      Ruan, Y.; Xu, Y.; Weng, W*. A cyclic cinnamate dimer mechanophore for      multimodal stress responsive and mechanically adaptable polymeric      materials, Poly. Chem. 2019, 10, 905.

10. 10.  Zhang, Y.; Chen, S.; Ying, F.; Su, P.*; Wu, W. Valence bond based      energy decomposition analysis scheme and its application to cation-pi      interactions, J. Phys. Chem. A. 2018, 122, 5886.

11. 11. Shen, D.; Su, P.*; Wu, W. What kind of neutral halogen bonds can be      modulated by solvent effects?, Phys. Chem. Chem. Phys. 2018, 20, 26126.

12. 12.  Zhou, C.; Zhang, Y.; Gong, X.; Ying, F.; Su, P.*; Wu, W.      Hamiltonian Matrix Correction Based Density Functional Valence Bond      Method, J. Chem. Theory Comput. 2017, 13, 627.

13. 13. Liu, Z.; Trindle, C.; Gu, Q.*; Wu, W.; Su, P.* Unravelling hydrogen      bonding interactions of tryptamine–water dimer from neutral to cation,      Phys. Chem. Chem. Phys. 2017, 19, 25260.

14. 14.  Chang, X.; Zhang, Y.; Weng X.; Su, P.*; Wu W.; Mo, Y. Red-shifting      versus blue-shifting hydrogen bonds perspective from ab initio valence      bond theory, J. Phys. Chem. A. 2016, 120, 2749.

15. 15. Su, P.*;      Chen, H.; Wu, W. An energy decomposition analysis study for intramolecular      non-covalent interaction in solvated environment, Sci. China Chem. 2016,      59, 1025.

16. 16. Chang, X.; Chen, Z.; Su, P.*; Wu, W. The CO rotation in the gaseous      glycine. An energy decomposition analysis study, Chem. Phys. Lett. 2015,      640, 194.

17. 17. Su, P.*;      Chen, Z.; Wu, W. An energy decomposition analysis study for intramolecular      non-covalent interaction, Chem. Phys. Lett. 2015, 635, 250.

18. 18. Huang, J.; Ying, F.; Su, P.*; and Wu W.* VBEFP/PCM: a QM/MM/PCM      approach for valence-bond method and its application for the vertical      excitations of formaldehyde and acetone in aqueous solution, Sci. China      Chem. 2014, 57, 1409.

19. 19. Su, P.*; Jiang Z.; Chen, Z.; Wu, W. "Energy decomposition      scheme based on the generalized Kohn–Sham scheme" J. Phys. Chem. A.      2014, 118, 2531.

20. 20. Chang, X.; Su, P.*; Wu, W. Internal rotation barrier of the      XH3YH3(X, Y = C or Si) molecules. An energy decomposition analysis study.      Chem. Phys. Lett. 2014, 610, 246.

21. 21. Su, P.;      and Wu. W.* Ab initio nonorthogonal valence bond methods. WIREs. Comput.      Mol. Sci. 2013, 3, 56.

22. 22. Ying, F.; Chang, X.; Su, P.*; and W. Wu. VBEFP: a valence bond      approach that incorporates effective fragment potential method. J. Chem.      Phys. A. 2012, 116, 1846.

23. 23.  苏培峰，吴玮*      经典价键理论的从头算计算方法,化学进展,      2012, 24, 1001.

24. 24. Su, P.*;      Liu, H.; Wu, W. Free energy decomposition analysis of bonding and      nonbonding interactions in solution." J. Chem. Phys. 2012, 137,      034111.

25. 25. Su, P.;      Wu, J.; Gu, J.; Wu, W.*; Shaik, S.*; Hiberty, P.* Bonding conundrums in      the C2 molecule: a valence bond study. J. Chem. Theory Comput. 2011, 7,      121.