Accurate potential energy surfaces for hydrogen abstraction reactions: A benchmark study on the XYG3 doubly hybrid density functional. - Jun Chen 012; Neil Qiang Su; Xin Xu 004; Dong H. Zhang (J. Comput. Chem., 2017)

An ab initio-based global potential energy surface for the SH3 system and full-dimensional state-to-state quantum dynamics study for the H2 + HS → H2S + H reaction. - Xin Xu 004; Jun Chen 012; Shu Liu 003; Dong H. Zhang (J. Comput. Chem., 2019)