Accurate potential energy surfaces for the first two lowest electronic states of the Li (2p) + H2 reaction
Author:
Affiliation:
1. Laboratory of Theoretical and Computational Chemistry
2. Institute of Theoretical Chemistry
3. Jilin University
4. Changchun
5. People’s Republic of China
Abstract
Accurate diabatic potential energy surfaces for the Li (2p) + H2 → LiH (X) + H reaction are produced.
Funder
National Natural Science Foundation of China
Ministry of Education of the People’s Republic of China
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemical Engineering,General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2018/RA/C8RA02504E
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