Supervisor of Doctorate Candidates
Supervisor of Master's Candidates
School/Department:现代物理研究所
Business Address:物理楼802室
Alma Mater:南开大学
Discipline:Atomic and Molecular Physics
Theoretical Physics
Condensed Matter Physics
Academic Honor:
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High-precision simulation of excited states and UV-Vis spectra of small molecules
High-precision simulation of excited states and UV-Vis spectra of small molecules.
[1] Wenli Zou and Wenjian Liu, Comprehensive theoretical studies on the low-lying electronic states of NiF, NiCl, NiBr, and NiI, J. Chem. Phys. 124, 154312 (2006).
[2] Wenli Zou and Wenjian Liu, Theoretical study on the low-lying electronic states of NiH and NiAt, J. Comput. Chem. 28, 2286 (2007).
[3] Wenli Zou and Wenjian Liu, Comprehensive ab initio calculation and simulation on the low-lying electronic states of TlX (X = F, Cl, Br, I, and At), J. Comput. Chem. 30, 524 (2009).
[4] Wenli Zou and James E. Boggs, Theoretical study of the electronic states of CuCl2, J. Chem. Phys. 130, 154313 (2009).
[5] J. C. Harms, K. A. Womack, L. C. O’Brien, and W. Zou, Analysis of New MoO Transition in the Near-IR: A Combined Theoretical and Experimental Study, J. Chem. Phys. 141, 134310 (2014).
[6] W. Zou and B. Suo, Theoretical Study of Low-Lying Electronic States of PtX (X = F, Cl, Br, and I) including Spin-Orbit Coupling, J. Phys. Chem. A, 120, 6357-6370 (2016).
[7] K. Shen, B. Suo, and W. Zou, Theoretical Study of Low-Lying Ω Electronic States of PtH and PtH+, J. Phys. Chem. A 121, 3699-3707 (2017).
[8] K. F. Ng, W. Zou, W. Liu, and A. S.-C. Cheung, Electronic Transitions of Tantalum Monofluoride, J. Chem. Phys. 146, 094308 (2017).
[9] Bingbing Suo, Yongqin Lian, Wenli Zou, and Yibo Lei, The Electronic Structure of OsSi Calculated by MS-NEVPT2 with Inclusion of the Relativistic Effects, J. Phys. Chem. A, 122, 5333-5341 (2018).
[10] L.F. Tsang, Man-Chor Chan, Wenli Zou, A.S.-C. Cheung, Electronic transitions of tungsten monosulfide, J. Mol. Spectrosc. 359, 31-36 (2019).
[11] L. C. O'Brien, J. C. Harms, J. J. O'Brien, W. Zou, Analysis of the A Ω=1 - X 3Σ‒0+ transition of PtS observed by intracavity laser spectroscopy with fourier transform detection (ILS-FTS), and computational studies of electronic states of PtS, J. Mol. Struct. 1211, 128024 (2020).
