120 citations · 343 across the 17 of their papers we have counts for
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Interference between multiple photoionization pathways in chiral molecules: Converging continuum results in Gaussian bases
Muhammad Sakhi, Alexander Blech, Corbin Allison +2
An accurate description of photoionization observables is a central challenge for theoretical models of molecular photoionization. Within standard electronic-structure approaches,…
Attosecond Control and Measurement of Chiral Photoionisation Dynamics
Meng Han, Jia-Bao Ji, Alexander Blech +5
Many chirality-sensitive light-matter interactions are governed by chiral electron dynamics. Therefore, the development of advanced technologies harnessing chiral phenomena would c…
Detecting coherent core-hole wave-packet dynamics in N2 by time- and angle-resolved inner-shell photoelectron spectroscopy
Ludger Inhester, Loren Greenman, Artem Rudenko +2
We propose an imaging technique to follow core-hole wave-packet oscillations in the nitrogen molecule. In this scheme, an attosecond x-ray pulse core-ionizes the nitrogen molecule…
Molecular Mechanics Simulations and Improved Tight-binding Hamiltonians for Artificial Light Harvesting Systems: Predicting Geometric Distributions, Disorder, and Spectroscopy of Chromophores in a Protein Environment
Joonho Lee, Donghyun Lee, Aleksey Kocherzhenko +4
We present molecular mechanics {and spectroscopic} calculations on prototype artificial light harvesting systems consisting of chromophores attached to a tobacco mosaic virus (TMV)…
Ultrafast Photodissociation Dynamics and Nonadiabatic Coupling Between Excited Electronic States of Methanol Probed by Time-Resolved Photoelectron Spectroscopy
Elio G. Champenois, Loren Greenman, Niranjan Shivaram +6
The electronic and nuclear dynamics in methanol, following 156~nm photoexcitation, are investigated by combining a detailed analysis of time-resolved photoelectron spectroscopy exp…
Variational treatment of electron-polyatomic molecule scattering calculations using adaptive overset grids
Loren Greenman, Robert R. Lucchese, C. William McCurdy
The Complex Kohn variational method for electron-polyatomic molecule scattering is formulated using an overset grid representation of the scattering wave function. The overset grid…