Analyzing Complex Reaction Mechanisms Using Path Sampling
Author:
Affiliation:
1. Department of Chemistry, Faculty of Natural Sciences and Technology, NTNU, Norwegian University of Science and Technology, 7941 Trondheim, Norway
Funder
Norges Forskningsråd
Faculty of Natural Sciences and Technology
Olav Thon Foundation
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.6b00642
Reference38 articles.
1. Kinetic Pathways of Ion Pair Dissociation in Water
2. TRANSITION PATH SAMPLING: Throwing Ropes Over Rough Mountain Passes, in the Dark
3. Transition Path Sampling
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5. Extensions to the likelihood maximization approach for finding reaction coordinates
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