A direct method for the location of the lowest energy point on a potential surface crossing

Intersection of potential energy surfaces in polyatomic molecules

G. Herzberg, H. C. Longuet–Higgins · Discussions of the Faraday Society · 1963 · 981 citations

Natural Sciences, Chemistry, Physics +17

The Crossing of Potential Surfaces.

Edward Teller · The Journal of Physical Chemistry · 1937 · 672 citations

Natural Sciences, Mathematics, Physics +6

An MC-SCF study of the S1 and S2 photochemical reactions of benzene

Ian J. Palmer, Ioannis N. Ragazos, Fernando Bernardi et al. · Journal of the American Chemical Society · 1993 · 264 citations

Natural Sciences, Chemistry, Chemical Kinetics +9

Determination of the lowest energy point on the crossing seam between two potential surfaces using the energy gradient

Nobuaki Koga, Keiji Morokuma · Chemical Physics Letters · 1985 · 247 citations

Natural Sciences, Computational Engineering, Surface Science +10

Characterization of the <i>S</i>1–<i>S</i>2 conical intersection in pyrazine using <i>ab</i> <i>initio</i> multiconfiguration self-consistent-field and multireference configuration-interaction methods

Clemens Woywod, Wolfgang Domcke, Andrzej L. Sobolewski et al. · The Journal of Chemical Physics · 1994 · 218 citations

Natural Sciences, Chemistry, Physics +17