نتایج جستجو برای: molecular electronic state

تعداد نتایج: 1639086  

2017
Henrik T Lemke Kasper S Kjær Robert Hartsock Tim B van Driel Matthieu Chollet James M Glownia Sanghoon Song Diling Zhu Elisabetta Pace Samir F Matar Martin M Nielsen Maurizio Benfatto Kelly J Gaffney Eric Collet Marco Cammarata

The description of ultrafast nonadiabatic chemical dynamics during molecular photo-transformations remains challenging because electronic and nuclear configurations impact each other and cannot be treated independently. Here we gain experimental insights, beyond the Born-Oppenheimer approximation, into the light-induced spin-state trapping dynamics of the prototypical [Fe(bpy)3]2+ compound by t...

2005
Maki Kawai

Inelastic electron process that leads to vibrational excitation has attracted much attention of since the conductivity of molecules bridging the electrodes is found to be strongly affected when they are vibrationally excited [1]. Considering that the conduction electrons passes through the electronic state crossing the Fermi level or hopping through the HOMO or LUMO state of the molecule, the e...

Journal: :The journal of physical chemistry. A 2011
Gil Katz Mark A Ratner Ronnie Kosloff

A minimal quantum mechanical model for efficient molecular capture of photon energy is presented. The model is constructed from a bright electronic state which is accessed by a photoinduced transition from the ground state and an acceptor excited state which stores the photoenergy. The model permits rational design of the bright and acceptor electronic states to improve the capture of solar ene...

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