| 1 |
Analysis of the Acting Forces in a Theory of Catalysis and Mechanochemistry
Quapp W, Bofill JM, Ribas-Arino J
Journal of Physical Chemistry A, 121(14), 2820, 2017 |
| 2 |
Comment on "Reaction Coordinates and Pathways of Mechanochemical Transformations"
Quapp W, Bofill JM
Journal of Physical Chemistry B, 120(9), 2644, 2016 |
| 3 |
Locating transition states on potential energy surfaces by the gentlest ascent dynamics
Bofill JM, Quapp W, Caballero M
Chemical Physics Letters, 583, 203, 2013 |
| 4 |
Search for conical intersection points (CI) by Newton trajectories
Quapp W, Bofill JM, Caballero M
Chemical Physics Letters, 541, 122, 2012 |
| 5 |
Finding the transition state of quasi-barrierless reactions by a growing string method for newton trajectories: Application to the dissociation of methylenecyclopropene and cyclopropane
Quapp W, Kraka E, Cremer D
Journal of Physical Chemistry A, 111(44), 11287, 2007 |
| 6 |
The reaction pathway of a potential energy surface as curve with induced tangent
Hirsch M, Quapp W
Chemical Physics Letters, 395(1-3), 150, 2004 |
| 7 |
Comment on "Critical points and reaction paths characterization on a potential energy hypersurface" [J. Chem. Phys. 112, 4923 (2000)]
Quapp W
Journal of Chemical Physics, 114(1), 609, 2001 |
