Searching for saddle points of potential energy surfaces by following a reduced gradient. - Wolfgang Quapp; Michael Hirsch 003; Olaf Imig; Dietmar Heidrich (J. Comput. Chem., 1998)

Comment On the quadratic reaction path evaluated in a reduced potential energy surface model and the problem to locate transition states [by J. M. Anglada, E. Besalú, J. M. Bofill, and R. Crehuet, J Comput Chem 2001, 22, 4, 387-406]. - Wolfgang Quapp (J. Comput. Chem., 2001)

Determination of energy minima and saddle points using multireference configuration interaction methods in combination with reduced gradient following: The S0 surface of H2CO and the T1 and T2 surfaces of acetylene. - Michal Dallos; Hans Lischka; Elizete Ventura Do Monte; Michael Hirsch 003; Wolfgang Quapp (J. Comput. Chem., 2002)

Improved RGF method to find saddle points. - Michael Hirsch 003; Wolfgang Quapp (J. Comput. Chem., 2002)

Reaction pathways and projection operators: Application to string methods. - Wolfgang Quapp (J. Comput. Chem., 2004)

Finding the transition state without initial guess: The growing string method for Newton trajectory to isomerization and enantiomerization reaction of alanine dipeptide and poly(15)alanine. - Wolfgang Quapp (J. Comput. Chem., 2007)

A comment to the nudged elastic band method. - Wolfgang Quapp; Josep Maria Bofill (J. Comput. Chem., 2010)

Transition state theory with Tsallis statistics. - Wolfgang Quapp; Alraune Zech (J. Comput. Chem., 2010)

Reply to the comment by Sheppard and Henkelman on the nudged elastic band method. - Wolfgang Quapp; Josep Maria Bofill (J. Comput. Chem., 2011)

Reaction rates in a theory of mechanochemical pathways. - Wolfgang Quapp; Josep Maria Bofill (J. Comput. Chem., 2016)

Some Mathematical Reasoning on the Artificial Force Induced Reaction Method. - Wolfgang Quapp; Josep Maria Bofill (J. Comput. Chem., 2020)