The local definition of the Optimum ascent path on a multi-dimensional potential energy surface and its practical application for the location of saddle points-Reference-Cited by-同舟云学术

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The local definition of the Optimum ascent path on a multi-dimensional potential energy surface and its practical application for the location of saddle points

Published:1981-09 Issue:3 Volume:60 Page:347-358
ISSN:0301-0104
Container-title:Chemical Physics
language:en
Short-container-title:Chemical Physics

Author:

Basilevsky M.V.,Shamov A.G.

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference34 articles.

1. Formulation of the reaction coordinate

2. Constituent analysis of the potential gradient along a reaction coordinate. Method and an application to methane + tritium reaction

3. Natural coordinates for polyatomic reactions

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