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A practical and efficient diabatization that combines Lorentz and Laplace functions to approximate nonadiabatic coupling terms

artículo científico publicado en 2015

A theoretical study of the low-lying excited electronic states of thiocarbonyl chlorofluoride and their dissociation pathways.

artículo científico publicado en 2007

Branching Ratio between Proton Transfer and Electron Transfer Channels of a Bidirectional Proton-Coupled Electron Transfer

artículo científico publicado en 2014

Dynamic Symmetry Breaking Hidden in Fano Resonance of a Molecule: S1 State of Diazirine Using Quantum Wave Packet Propagation

scientific article published on 04 February 2016

Electronic and non-adiabatic dynamics: general discussion

artículo científico publicado en 2016

Factors Affecting the Branching Ratio of Photodissociation: Thiophenol Studied through Quantum Wavepacket Dynamics.

artículo científico publicado en 2015

Practical approximation of the non-adiabatic coupling terms for same-symmetry interstate crossings by using adiabatic potential energies only.

artículo científico publicado en 2017

Quantum wave packet propagation study of the photochemistry of phenol: isotope effects (Ph-OD) and the direct excitation to the 1πσ* state

artículo científico publicado en 2011

State-selective predissociation dynamics of methylamines: the vibronic and HD effects on the conical intersection dynamics

artículo científico publicado en 2008

Structural dynamics: general discussion

artículo científico publicado en 2016

Structure of pyridazine in the S1 state: experiment and theory.

artículo científico publicado en 2008

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