A strategy for obtaining a more accurate transition state estimate using the growing string method

Chemical Physics Letters

Volumn 484, Issue 4-6, 2010, Pages 392-398

  Goodrow, Anthony ^a   Bell, Alexis T ^a   Head Gordon, Martin ^b  

^a University of California   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CPU TIME; IN-PHASE; REACTION PATHWAYS; REPARAMETERIZATION; STRING METHODS; TRANSITION STATE;

PHASE SPACE METHODS;

STATE ESTIMATION;

EID: 72649090703     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2009.11.050     Document Type: Article

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