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Paper

An accurate multi-channel multi-reference full-dimensional global potential energy surface for the lowest triplet state of H2O2

Jun Li,*ab   Richard Dawes*c and   Hua Guo*b  
*
Corresponding authors
a
School of Chemistry and Chemical Engineering, Chongqing University, Chongqing 401331, China
E-mail: jli15@cqu.edu.cn
b
Department of Chemistry and Chemical Biology, University of New Mexico, Albuquerque, USA
E-mail: hguo@unm.edu
c
Department of Chemistry, Missouri University of Science and Technology, Rolla, USA
E-mail: dawesr@mst.edu
Phys. Chem. Chem. Phys., 2016,18, 29825-29835

DOI: 10.1039/C6CP06232F
Received 09 Sep 2016, Accepted 29 Sep 2016
First published online 06 Oct 2016
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