7 citations · 8 across the 3 of their papers we have counts for
5 papers
Few-femtosecond electronic and structural rearrangements of CH driven by the Jahn-Teller effect
Kristina S. Zinchenko, Fernando Ardana-Lamas, Valentina Utrio Lanfaloni +5
The Jahn-Teller effect (JTE) is central to the understanding of the physical and chemical properties of a broad variety of molecules and materials. Whereas the manifestations of th…
A Laboratory Frame Density Matrix for Ultrafast Quantum Molecular Dynamics
Margaret Gregory, Simon Neville, Michael Schuurman +1
In most cases the ultrafast dynamics of resonantly excited molecules are considered, and almost always computed in the molecular frame, while experiments are carried out in the lab…
Removing the deadwood from DFT/MRCI wave functions: The p-DFT/MRCI method
Simon P. Neville, Michael S. Schuurman
The combined density functional theory and multireference configuration interaction (DFT/MRCI) method is a powerful tool for the calculation of excited electronic states of large m…
The role of geometric phase in the formation of electronic coherences at conical intersections
Simon P. Neville, Albert Stolow, Michael S. Schuurman
The direct observation of non-adiabatic dynamics at conical intersections is a long-standing goal of molecular physics. Novel time-resolved spectroscopies have been proposed which…
Ultrafast X-ray spectroscopy of conical intersections
Simon P. Neville, Majed Chergui, Albert Stolow +1
Ongoing developments in ultrafast X-ray sources offer powerful new means of probing the com- plex non-adiabatically coupled structural and electronic dynamics of photoexcited molec…