TITLE

Finding transition states using contangency curves

AUTHOR(S)
Ulitsky, Alex; Shalloway, David
PUB. DATE
June 1997
SOURCE
Journal of Chemical Physics;6/22/1997, Vol. 106 Issue 24, p10099
SOURCE TYPE
Academic Journal
DOC. TYPE
Article
ABSTRACT
Presents a method for approximating reaction paths and transition states of conformational transitions in polyatomic systems. Quasi-harmonic bi-Gaussian approximation; Contangency curve; Temperature dependence; Computational example.
ACCESSION #
4228053

 

Related Articles

Share

Read the Article

Courtesy of THE LIBRARY OF VIRGINIA

Sorry, but this item is not currently available from your library.

Try another library?
Sign out of this library

Other Topics