A New Algorithm for Efficient Direct Dynamics Calculations of Large-Curvature Tunneling and Its Application to Radical Reactions with 9−15 Atoms
Fernández-Ramos, Antonio, Truhlar, Donald G.Volume:
1
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct050153i
Date:
November, 2005
File:
PDF, 418 KB
english, 2005