dynamic reaction path (DRP)

https://doi.org/10.1351/goldbook.DT07021
A classical trajectory method based on @M03996@ calculations which determines atomic accelerations, velocities and positions using the @ET07028@, and does not require prior knowledge of the potential energy surface.
Source:
PAC, 1999, 71, 1919. (Glossary of terms used in theoretical organic chemistry) on page 1935 [Terms] [Paper]
Citation: 'dynamic reaction path' in IUPAC Compendium of Chemical Terminology, 3rd ed. International Union of Pure and Applied Chemistry; 2006. Online version 3.0.1, 2019. https://doi.org/10.1351/goldbook.DT07021 RIS BibTex EndNote
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Last revised: February 24, 2014