Research

科研工作

我的研究兴趣涵盖理论与计算化学,目前主要关注电子结构理论,尤其是面向激发态的密度泛函方法发展。

论文

  • Chengeng Sun, YL, Chen Li*, Exact factorization of fermionic many-body excited-state wave functions: Case study of the harmonic problem, Phys. Rev. A, Accepted.
  • YL, Chen Li*, Efficient prediction of singlet-triplet gaps in delayed fluorescence emitters using Kohn-Sham orbital energies, J. Phys. Chem. Lett., 17(1), 141-148, 2026. [link]
  • Zixuan Wang, YL, Chen Li*, Testing exact-factorization-based density functional approximation on a continuous density model, J. Chem. Phys., 162, 234104, 2025. [link]
  • YL, Chen Li*, Localized orbital scaling correction to linear-response time-dependent density functional approximations, J. Chem. Theory Comput., 21, 11, 5514-5522, 2025. [link]
  • YL, Zixuan Wang, Chen Li*, Understanding molecular geometric phase effects with exact effective force: case study of a model system, J. Phys.: Condens. Matter, 36, 465201, 2024. [link]

完整信息见 CV。

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