259 citations · 854 across the 15 of their papers we have counts for
15 papers
Shedding Light on Correlated Electron-Photon States using the Exact Factorization
Ali Abedi, Elham Khosravi, Ilya Tokatly
The Exact Factorization framework is extended and utilized to introduce the electronic-states of correlated electron-photon systems. The formal definitions of an exact scalar poten…
Electronic Non-adiabatic Dynamics in Enhanced Ionization of Isotopologues of H from the Exact Factorization Perspective
E. Khosravi, A. Abedi, A. Rubio +1
It was recently shown that the exact potential driving the electron's dynamics in enhanced ionization of H can have large contributions arising from dynamical electron-nuclea…
Universal Steps in Quantum Dynamics with Time-Dependent Potential-Energy Surfaces: Beyond the Born-Oppenheimer Picture
Guillermo Albareda, Ali Abedi, Ivano Tavernelli +1
It was recently shown [G. Albareda, et al., Phys. Rev. Lett. 113, 083003 (2014)] that within the conditional decomposition approach to the coupled electron-nuclear dynamics, the el…
Quantum-Classical Non-Adiabatic Dynamics: Coupled- vs. Independent-Trajectory Methods
Federica Agostini, Seung Kyu Min, Ali Abedi +1
Trajectory-based mixed quantum-classical approaches to coupled electron-nuclear dynamics suffer from well-studied problems such as the lack of (or incorrect account for) decoherenc…
The Exact Potential Driving the Electron Dynamics in Enhanced Ionization
Elham Khosravi, Ali Abedi, Neepa T. Maitra
It was recently shown that the exact factorization of the electron-nuclear wavefunction allows the construction of a Schrödinger equation for the electronic system, in which the po…
Classical nuclear motion coupled to electronic non-adiabatic transitions
Federica Agostini, Ali Abedi, E. K. U. Gross
We present a detailed derivation and numerical tests of a new mixed quantum-classical scheme to deal with non-adiabatic processes. The method is presented as the zero-th order appr…
The exact forces on classical nuclei in non-adiabatic charge transfer
Federica Agostini, Ali Abedi, Yasumitsu Suzuki +3
The decomposition of electronic and nuclear motion presented in~[A. Abedi, N. T. Maitra, and E. K. U. Gross, Phys. Rev. Lett. 105, 123002 (2010)] yields a time-dependent potential…
Correlated Electron-Nuclear Dynamics with Conditional Wave Functions
Guillermo Albareda, Heiko Appel, Ignacio Franco +2
The molecular Schrödinger equation is rewritten in terms of non-unitary equations of motion for the nuclei (or electrons) that depend parametrically on the configuration of an ense…
Mixed quantum-classical dynamics from the exact decomposition of electron-nuclear motion
Ali Abedi, Federica Agostini, E. K. U. Gross
We present a novel mixed quantum-classical approach to the coupled electron-nuclear dynamics based on the exact factorization of the electron-nuclear wave function, recently propos…
Is the molecular Berry phase an artifact of the Born-Oppenheimer approximation?
S. K. Min, A. Abedi, K. S. Kim +1
We demonstrate that the molecular Berry phase and the corresponding non-analyticity in the electronic Born-Oppenheimer wavefunction is, in general, not a true topological feature o…
Exact Electronic Potentials in Coupled Electron-Ion Dynamics
Yasumitsu Suzuki, Ali Abedi, Neepa T. Maitra +2
We develop a novel approach to the coupled motion of electrons and ions that focuses on the dynamics of the electronic subsystem. Usually the description of electron dynamics invol…
Reply to "Comment on 'Correlated electron-nuclear dynamics: Exact factorization of the molecular wavefunction' [J. Chem. Phys. 137, 22A530 (2012) ]''
Ali Abedi, Neepa T. Maitra, E. K. U. Gross
This is a reply to the comment by J. L. Alonso et al. (arXiv:1302.6146; to appear in J. Chem. Phys) on our paper A. Abedi, N. T. Maitra, and E. K. U. Gross, J. Chem. Phys. 137, 22A…
Mixed quantum-classical dynamics on the exact time-dependent potential energy surface: A fresh look at non-adiabatic processes
Federica Agostini, Ali Abedi, Yasumitsu Suzuki +1
The exact nuclear time-dependent potential energy surface arises from the exact decomposition of electronic and nuclear motion, recently presented in [A. Abedi, N. T. Maitra, and E…
Steps in the exact time-dependent potential energy surface
Ali Abedi, Federica Agostini, Yasumitsu Suzuki +1
We study the exact Time-Dependent Potential Energy Surface (TDPES) in the presence of strong non-adiabatic coupling between the electronic and nuclear motion. The concept of the TD…
Correlated electron-nuclear dynamics: Exact factorization of the molecular wavefunction
Ali Abedi, Neepa T. Maitra, E. K. U. Gross
It was recently shown [Phys. Rev. Lett. 105, 123002 (2010)] that the complete wavefunction for a system of electrons and nuclei evolving in a time-dependent external potential can…