Theory of electronic resonances: fundamental aspects and recent advances

TC Jagau - Chemical Communications, 2022 - pubs.rsc.org
Electronic resonances are states that are unstable towards loss of electrons. They play
critical roles in high-energy environments across chemistry, physics, and biology but are …

Electron collisions in atmospheres

L Campbell, MJ Brunger - International Reviews in Physical …, 2016 - Taylor & Francis
Collisions with electrons from several sources are common throughout planetary
atmospheres. While in most circumstances direct electron impact is less significant than …

Roadmap on dynamics of molecules and clusters in the gas phase

H Zettergren, A Domaracka, T Schlathölter… - The European Physical …, 2021 - Springer
This roadmap article highlights recent advances, challenges and future prospects in studies
of the dynamics of molecules and clusters in the gas phase. It comprises nineteen …

Distant symmetry control in electron-induced bond cleavage

TP Ragesh Kumar, P Nag, M Rankovic… - The Journal of …, 2022 - ACS Publications
We experimentally show that N–H bond cleavage in the pyrrole molecule following resonant
electron attachment is allowed and controlled by the motion of the atoms which are not …

Electron scattering and transport in biofuels, biomolecules and biomass fragments

MJ Brunger - International Reviews in Physical Chemistry, 2017 - Taylor & Francis
We review a selection of recent experimental and theoretical cross section results for
electron scattering from a range of biofuels (methanol, ethanol), biomolecules (water …

Implementation of a model potential in the Schwinger multichannel method to describe polarization in positron-atom and-molecule scattering: Studies for the noble …

FF Frighetto, AS Barbosa, SA Sanchez - Physical Review A, 2023 - APS
In this study, we evaluated a polarization scheme within the framework of the Schwinger
multichannel method, using a model potential to describe positron-molecule polarization …

R-matrix calculations for elastic electron and positron scattering from pyrazine: effect of the polarization description

V Graves, JD Gorfinkiel - The European Physical Journal D, 2022 - Springer
We present R-matrix calculations of electron and positron low energy scattering from the
highly polarizable pyrazine molecule. We compare integral and differential elastic cross …

Electron Scattering from 1-Methyl-5-Nitroimidazole: Cross-Sections for Modeling Electron Transport through Potential Radiosensitizers

AI Lozano, L Álvarez, A García-Abenza… - International Journal of …, 2023 - mdpi.com
In this study, we present a complete set of electron scattering cross-sections from 1-Methyl-5-
Nitroimidazole (1M5NI) molecules for impact energies ranging from 0.1 to 1000 eV. This …

State of the art in dissociative electron attachment spectroscopy and its prospects

SA Pshenichnyuk, NL Asfandiarov, AS Vorob'ev… - Physics …, 2022 - iopscience.iop.org
The latest achievements are presented in experimental and theoretical studies of resonance
scattering of low-energy (0–15-eV) electrons from molecular targets in a gas phase resulting …

[HTML][HTML] Comparative study of methodologies for calculating metastable states of small to medium-sized molecules

M Thodika, M Fennimore, TNV Karsili… - The Journal of chemical …, 2019 - pubs.aip.org
We present a benchmarking study on the performance of two methods at the forefront of
studying electronic metastable states of molecules: the orbital stabilization method and the …