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The Journal of Chemical Physics|October 17, 2015
Methane dissociation on Ni(111): A fifteen-dimensional potential energy surface using neural network methodXiangjian Shen, Jun Chen, Zhaojun Zhang, et al.Journal of Chemical Theory and Computation|April 27, 2026
Monomeric Neural Network Potential for General Covalent Molecules: Linear Alkanes as an ExampleXinze Li, Ruitao Ma, Chen Qu, et al.The Journal of Physical Chemistry Letters|August 21, 2015
Theoretical Study of the Validity of the Polanyi Rules for the Late-Barrier Cl + CHD3 ReactionZhaojun Zhang, Yong Zhou, Dong H Zhang, et al.The Journal of Chemical Physics|March 2, 2015
H + H2 quantum dynamics using potential energy surfaces based on the XYG3 type of doubly hybrid density functionals: validation of the density functionalsNeil Qiang Su, Jun Chen, Zhigang Sun, et al.The Journal of Chemical Physics|May 12, 2007
Wave packet theory of dynamic stimulated Raman spectra in femtosecond pump-probe spectroscopyZhigang Sun, Zhongqi Jin, J Lu, et al.The Journal of Chemical Physics|June 3, 2016
Full-dimensional vibrational calculations of five-atom molecules using a combination of Radau and Jacobi coordinates: Applications to methane and fluoromethaneZhiqiang Zhao, Jun Chen, Zhaojun Zhang, et al.Journal of the American Chemical Society|April 18, 2023
Quantum Tunneling in Peroxide O-O Bond Breaking ReactionYangyu Zhou, Wei Fang, Lina Wang, et al.Journal of Chemical Theory and Computation|October 17, 2025
Instanton Theory for Nonadiabatic Tunneling through Near-Barrier CrossingsZiyan Ye, Eric R Heller, Dong H Zhang, et al.Nature Communications|November 24, 2025
State-correlated reaction dynamics unveiled in full from a single product-image measurementHuilin Pan, Shu Liu, Pengcheng Wang, et al.Chemical Science|July 22, 2022
Strong non-Arrhenius behavior at low temperatures in the OH + HCl → H2O + Cl reaction due to resonance induced quantum tunnelingXin Xu, Jun Chen, Xiaoxiao Lu, et al.Pageof 24