Complex Chemical Reaction Networks from Heuristics-Aided Quantum Chemistry
Author:
Affiliation:
1. Department of Chemistry and Chemical Biology, Harvard University, 12 Oxford Street, Cambridge, Massachusetts 02138, United States
2. Pomona College, 333 North College Way, Claremont, California 91711, United States
Funder
National Science Foundation
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct401004r
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1. Unraveling Reaction Pathways and Specifying Reaction Kinetics for Complex Systems
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