Time-dependent wave packet state-to-state dynamics of H/D + HCl/DCl reactions

The H/D + HCl/DCl (v0 = 0, j0 = 0) reactions were investigated in the gas phase using the reactant coordinate based time-dependent wave packet method on the BW2 PES [W. Bian and H.-J. Werner, J. Chem. Phys. 112, 220 (2000)]. The total and state-to-state integral and differential cross sections of bo...

Täydet tiedot

Bibliografiset tiedot
Päätekijät: Song, Hongwei, Lee, Soo-Ying, Sun, Zhigang, Lu, Yunpeng
Muut tekijät: School of Physical and Mathematical Sciences
Aineistotyyppi: Journal Article
Kieli:English
Julkaistu: 2013
Aiheet:
Linkit:https://hdl.handle.net/10356/95772
http://hdl.handle.net/10220/10035