Some of the recent developments in the quantum dynamical studies at the conical intersections of molecular potential energy surfaces is briefly reviewed in this article. Particular emphasis is given to a variety of molecular processes studied by us in the recent past. The non-adiabatic effects due both to the electronic as well as relativistic spin–orbit coupling are considered. The discussions include the Jahn–Teller effect (and also the pseudo-Jahn–Teller effect whenever applicable) in the Rydberg emission spectrum of triatomic hydrogen and the photoelectron spectrum of cyclopropane and methyl fluoride, probing the conical intersections in ClO<SUB>2</SUB> and the reagent van der Waals well in the Cl(<SUP>2</SUP>P)+H<SUB>2</SUB> reaction ...
This thesis is based on theoretical studies of molecular collisions occurring at relatively low to i...
This thesis is based on theoretical studies of molecular collisions occurring at relatively low to i...
Conical intersections of potential energy surfaces widely appear in molecules which consist of more ...
The question of how to describe the crossing of molecular electronic states is one of the most chall...
Reaction dynamics of prototypical, D + H2 and Cl (2P) + H2, chemical reactions occurring through the...
The nonadiabatic coupling of electronic and vibrational degrees of freedom is the defining feature o...
The concept of adiabatic electronic potential-energy surfaces, defined by the Born–Oppenheimer appro...
The concept of adiabatic electronic potential-energy surfaces, defined by the Born-Oppenheimer appro...
Author Institution: School of Chemistry, University of Bristol, Bristol BS8 1TH, UKNon-adiabatic int...
Author Institution: School of Chemistry, University of Bristol, Bristol BS8 1TH, UKNon-adiabatic int...
Author Institution: Department of Chemistry, King's College London; Istituto di Chimica Organica, Un...
Zhao B, Manthe U. Non-adiabatic transitions in the reaction of fluorine with methane. The Journal of...
Nonadiabatic quantum scattering calculations have been carried out for the reactive and nonreactive ...
Conical intersections between molecular electronic potential energy surfaces can greatly affect mole...
Potential energy surfaces for electronic states of molecules in strong electromagnetic fields can be...
This thesis is based on theoretical studies of molecular collisions occurring at relatively low to i...
This thesis is based on theoretical studies of molecular collisions occurring at relatively low to i...
Conical intersections of potential energy surfaces widely appear in molecules which consist of more ...
The question of how to describe the crossing of molecular electronic states is one of the most chall...
Reaction dynamics of prototypical, D + H2 and Cl (2P) + H2, chemical reactions occurring through the...
The nonadiabatic coupling of electronic and vibrational degrees of freedom is the defining feature o...
The concept of adiabatic electronic potential-energy surfaces, defined by the Born–Oppenheimer appro...
The concept of adiabatic electronic potential-energy surfaces, defined by the Born-Oppenheimer appro...
Author Institution: School of Chemistry, University of Bristol, Bristol BS8 1TH, UKNon-adiabatic int...
Author Institution: School of Chemistry, University of Bristol, Bristol BS8 1TH, UKNon-adiabatic int...
Author Institution: Department of Chemistry, King's College London; Istituto di Chimica Organica, Un...
Zhao B, Manthe U. Non-adiabatic transitions in the reaction of fluorine with methane. The Journal of...
Nonadiabatic quantum scattering calculations have been carried out for the reactive and nonreactive ...
Conical intersections between molecular electronic potential energy surfaces can greatly affect mole...
Potential energy surfaces for electronic states of molecules in strong electromagnetic fields can be...
This thesis is based on theoretical studies of molecular collisions occurring at relatively low to i...
This thesis is based on theoretical studies of molecular collisions occurring at relatively low to i...
Conical intersections of potential energy surfaces widely appear in molecules which consist of more ...