Automated Transition State Theory Calculations for High-Throughput Kinetics
Author:
Affiliation:
1. Department of Chemical Engineering, Northeastern University, Boston, Massachusetts 02115, United States
Funder
National Science Foundation
American Chemical Society
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.7b07361
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