A density functional study of the simplest hydrogen abstraction reaction. Effect of self-interaction correction
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference55 articles.
1. Ab initio study of the reactions between methane and hydroxyl, hydrogen atom, and triplet oxygen atom
2. Calculated barrier to hydrogen atom abstraction from CH4 by O(3P)
3. A theoretical study of deuterium isotope effects in the reactions molecular hydrogen + methyl and atomic hydrogen + methane
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