Yinan Shu

20132020

Research output per year

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Research Output

  • 20 Article
  • 1 Conference contribution

Conservation of Angular Momentum in Direct Nonadiabatic Dynamics

Shu, Y., Zhang, L., Varga, Z., Parker, K. A., Kanchanakungwankul, S., Sun, S. & Truhlar, D. G., Feb 6 2020, In : Journal of Physical Chemistry Letters. 11, 3, p. 1135-1140 6 p.

Research output: Contribution to journalArticle

  • Direct diabatization and analytic representation of coupled potential energy surfaces and couplings for the reactive quenching of the excited 2ς+ state of OH by molecular hydrogen

    Shu, Y., Kryven, J., Sampaio De Oliveira-Filho, A. G., Zhang, L., Song, G. L., Li, S. L., Meana-Pañeda, R., Fu, B., Bowman, J. M. & Truhlar, D. G., Sep 14 2019, In : Journal of Chemical Physics. 151, 10, 104311.

    Research output: Contribution to journalArticle

    Open Access
  • 2 Scopus citations

    Dynamics of recombination: Via conical intersection in a semiconductor nanocrystal

    Peng, W. T., Fales, B. S., Shu, Y. & Levine, B. G., Jan 1 2018, In : Chemical Science. 9, 3, p. 681-687 7 p.

    Research output: Contribution to journalArticle

    Open Access
  • 8 Scopus citations

    Extended Hamiltonian molecular dynamics: Semiclassical trajectories with improved maintenance of zero point energy

    Shu, Y., Dong, S. S., Parker, K. A., Bao, J. L., Zhang, L. & Truhlar, D. G., Jan 1 2018, In : Physical Chemistry Chemical Physics. 20, 48, p. 30209-30218 10 p.

    Research output: Contribution to journalArticle

  • 2 Scopus citations
  • 3 Scopus citations