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List of works by Shaozeng Sun

Association of Cl with C2H2 by unified variable-reaction-coordinate and reaction-path variational transition-state theory

scientific article published on 02 March 2020

Conservation of Angular Momentum in Direct Nonadiabatic Dynamics

scientific article published on 28 January 2020

Dynamics of Cl-(H2O) + CH3I Substitution Reaction: The Influences of Solvent and Nucleophile

scientific article published on 06 March 2019

Effects of Water Molecule on CO Oxidation by OH: Reaction Pathways, Kinetic Barriers, and Rate Constants

scientific article published on 14 June 2017

Full-dimensional three-state potential energy surfaces and state couplings for photodissociation of thiophenol

scientific article published on 01 October 2019

Nonadiabatic Dynamics Algorithms with Only Potential Energies and Gradients: Curvature-Driven Coherent Switching with Decay of Mixing and Curvature-Driven Trajectory Surface Hopping

scientific article published on 01 February 2022

Recommendation of Orbitals for <i>G</i><sub>0</sub><i>W</i><sub>0</sub> Calculations on Molecules and Crystals

scientific article published on 17 May 2022

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