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bib=H. P. Hratchian and H. B. Schlegel, ''Following Reaction Pathways Using a Damped Classical Trajectory Algorithm'', J. Phys. Chem. A '''106''', 165 (2002).|
bib=H. P. Hratchian and H. B. Schlegel, ''Following Reaction Pathways Using a Damped Classical Trajectory Algorithm'', J. Phys. Chem. A '''106''', 165 (2002).|
link=https://pubs.acs.org/doi/abs/10.1021/jp012125b
link=https://pubs.acs.org/doi/abs/10.1021/jp012125b
}}{{
Reference|key=henkelman:jpc:1999|show={{{1}}}|
bib=G. Henkelman and H. Jónsson, ''A dimer method for finding saddle points on high dimensional potential surfaces using only first derivatives'', J. Chem. Phys. '''111''', 7010–7022 (1999).|
link=http://aip.scitation.org/doi/10.1063/1.480097
}}{{
Reference|key=heyden:jpc:2005|show={{{1}}}|
bib=A. Heyden, A. T. Bell, and F. J. Keil, ''Efficient methods for finding transition states in chemical reactions: Comparison of improved dimer method and partitioned rational function optimization method'', J. Chem. Phys. '''123''', 224101 (2005).|
link=http://aip.scitation.org/doi/10.1063/1.2104507
}}
}}

Revision as of 13:33, 12 November 2023