All Stories

  1. Theoretical study of the O(3P) + CN(X2Σ+) → CO(X1Σ+) + N(2D)/N(4S) reactions

    Article • The Journal of Chemical Physics, February 2024, American Institute of Physics

    Hua Guo

  2. A time-dependent quantum approach to dissociative recombination, associative ionization, and Penning ionization

    Article • The Journal of Chemical Physics, July 2023, American Institute of Physics

    Hua Guo

  3. ABC+D: A time-independent coupled-channel quantum dynamics program for elastic and ro-vibrational inelastic scattering between atoms and triatomic molecules in full dimensionality

    Article • The Journal of Chemical Physics, February 2023, American Institute of Physics

    Hua Guo

  4. Extended coupled-states approximation for full-dimensional quantum treatments of rovibrationally inelastic scattering between atoms and triatomic molecules

    Article • The Journal of Chemical Physics, October 2022, American Institute of Physics

    Hua Guo

  5. Quantum dynamics with ab initio potentials

    Article • The Journal of Chemical Physics, August 2021, American Institute of Physics

    Hua Guo

  6. Rainbow scattering in rotationally inelastic collisions of HCl and H2

    Article • The Journal of Chemical Physics, March 2021, American Institute of Physics

    Hua Guo

  7. Enabling complete multichannel nonadiabatic dynamics: A global representation of the two-channel coupled, 1,21A and 13A states of NH3 using neural networks

    Article • The Journal of Chemical Physics, March 2021, American Institute of Physics

    Hua Guo

  8. Insights into adsorption, diffusion, and reactions of atomic nitrogen on a highly oriented pyrolytic graphite surface

    Article • The Journal of Chemical Physics, February 2021, American Institute of Physics

    Hua Guo

  9. Exploring reactivity and product formation in N(4S) collisions with pristine and defected graphene with direct dynamics simulations

    Article • The Journal of Chemical Physics, November 2020, American Institute of Physics

    Hua Guo

  10. Time-independent quantum theory on vibrational inelastic scattering between atoms and open-shell diatomic molecules: Applications to NO + Ar and NO + H scattering

    Article • The Journal of Chemical Physics, October 2020, American Institute of Physics

    Hua Guo

  11. Energy transfer between vibrationally excited carbon monoxide based on a highly accurate six-dimensional potential energy surface

    Article • The Journal of Chemical Physics, August 2020, American Institute of Physics

    Hua Guo

  12. Statistical quantum mechanical approach to diatom–diatom capture dynamics and application to ultracold KRb + KRb reaction

    Article • The Journal of Chemical Physics, June 2020, American Institute of Physics

    Hua Guo

  13. Neural network based quasi-diabatic Hamiltonians with symmetry adaptation and a correct description of conical intersections

    Article • The Journal of Chemical Physics, June 2019, American Institute of Physics

    Hua Guo

  14. Dynamics in reactions on metal surfaces: A theoretical perspective

    Article • The Journal of Chemical Physics, May 2019, American Institute of Physics

    Hua Guo

  15. Bond dissociation energy of Au2+: A guided ion beam and theoretical investigation

    Article • The Journal of Chemical Physics, May 2019, American Institute of Physics

    Peter Armentrout, Hua Guo, Cameron Owen

  16. Accurate characterization of the lowest triplet potential energy surface of SO2 with a coupled cluster method

    Article • The Journal of Chemical Physics, April 2019, American Institute of Physics

    Bill Poirier, Hua Guo

  17. Quantum dynamical investigation of product state distributions of the F + CH3OH → HF + CH3O reaction via photodetachment of the F−(HOCH3) anion

    Article • The Journal of Chemical Physics, January 2019, American Institute of Physics

    Hua Guo, Jun Li

  18. Recent Advances in Quantum Dynamics of Bimolecular Reactions

    Article • Annual Review of Physical Chemistry, May 2016, Annual Reviews

    Hua Guo

  19. Quantum dynamics of polyatomic dissociative chemisorption on transition metal surfaces: mode specificity and bond selectivity

    Article • Chemical Society Reviews, January 2016, Royal Society of Chemistry

    Hua Guo

  20. Insights into the bond-selective reaction of Cl + HOD(nOH) → HCl + OD

    Article • Physical Chemistry Chemical Physics, January 2015, Royal Society of Chemistry

    Hua Guo, Jun Li

  21. Six-dimensional quantum dynamics of dissociative chemisorption of H2on Co(0001) on an accurate global potential energy surface

    Article • Physical Chemistry Chemical Physics, January 2015, Royal Society of Chemistry

    Hua Guo

  22. Nine-dimensional quantum dynamics study of the H2+ NH2→ H + NH3reaction: a rigorous test of the sudden vector projection model

    Article • Physical Chemistry Chemical Physics, July 2014, Royal Society of Chemistry

    Hua Guo, Jun Li

  23. A nine-dimensional global potential energy surface for NH4(X2A1) and kinetics studies on the H + NH3↔ H2+ NH2reaction

    Article • Physical Chemistry Chemical Physics, January 2014, Royal Society of Chemistry

    Hua Guo, Jun Li

  24. State-to-state quantum dynamics of the F + HCl (vi = 0, ji = 0) → HF(vf, jf) + Cl reaction on the ground state potential energy surface

    Article • Physical Chemistry Chemical Physics, January 2013, Royal Society of Chemistry

    Hua Guo, Dr Zhigang Sun

  25. Calculation of multiple initial state selected reaction probabilities from Chebyshev flux-flux correlation functions: Influence of reactant internal excitations on H + H2O → OH + H2

    Article • The Journal of Chemical Physics, August 2011, American Institute of Physics

    Hua Guo