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Ring-polymer molecular dynamical calculations for the F + HCl → HF + Cl reaction on the ground 12A′ potential energy surface

Mengna Bai,a   Dandan Lu,a   Yongle Li*b and   Jun Li*a  
Corresponding authors
School of Chemistry and Chemical Engineering, Chongqing University, Chongqing 401331, China
Department of Physics, International Center of Quantum and Molecular Structure, and Shanghai Key Laboratory of High Temperature Superconductors, Shanghai University, Shanghai 200444, China
Phys. Chem. Chem. Phys., 2016,18, 32031-32041

DOI: 10.1039/C6CP03306G
Received 16 May 2016, Accepted 27 Jun 2016
First published online 28 Jun 2016
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