Interatomic and intermolecular Coulombic decay

T Jahnke, U Hergenhahn, B Winter, R Dörner… - Chemical …, 2020 - ACS Publications
Interatomic or intermolecular Coulombic decay (ICD) is a nonlocal electronic decay
mechanism occurring in weakly bound matter. In an ICD process, energy released by …

Complex absorbing potentials

JG Muga, JP Palao, B Navarro, IL Egusquiza - Physics Reports, 2004 - Elsevier
We review the construction and use of complex potentials in reactive scattering and other
molecular collisions to calculate continuum quantities (such as state-to-state transition …

Interatomic and intermolecular Coulombic decay: the coming of age story

T Jahnke - Journal of Physics B: Atomic, Molecular and Optical …, 2015 - iopscience.iop.org
In pioneering work by Cederbaum et al an excitation mechanism was proposed that occurs
only in loosely bound matter (Cederbaum et al 1997 Phys. Rev. Lett. 79 4778): it turned out …

Experimental evidence for interatomic Coulombic decay in Ne clusters

S Marburger, O Kugeler, U Hergenhahn, T Möller - Physical review letters, 2003 - APS
Electron spectra of photoexcited Ne clusters are shown to display a signal at low kinetic
energies that is neither present in the Ne monomer nor at photon energies below the inner …

A hitherto unrecognized source of low-energy electrons in water

M Mucke, M Braune, S Barth, M Förstel, T Lischke… - Nature Physics, 2010 - nature.com
Low-energy electrons are the most abundant product of ionizing radiation in condensed
matter. The origin of these electrons is most commonly understood to be secondary …

Extending quantum chemistry of bound states to electronic resonances

TC Jagau, KB Bravaya, AI Krylov - Annual review of physical …, 2017 - annualreviews.org
Electronic resonances are metastable states with finite lifetime embedded in the ionization
or detachment continuum. They are ubiquitous in chemistry, physics, and biology …

Implementation of the time-dependent configuration-interaction singles method for atomic strong-field processes

L Greenman, PJ Ho, S Pabst, E Kamarchik… - Physical Review A …, 2010 - APS
We present an implementation of the time-dependent configuration-interaction singles
(TDCIS) method for treating atomic strong-field processes. In order to absorb the …

[ΒΙΒΛΙΟ][B] Structure and properties of atomic nanoclusters

JA Alonso - 2012 - books.google.com
Atomic clusters are aggregates of atoms containing a few to several thousand atoms. Due to
the small size of these pieces of matter, the properties of atomic clusters in general are …

Transient absorption and resha** of ultrafast XUV light by laser-dressed helium

MB Gaarde, C Buth, JL Tate, KJ Schafer - Physical Review A—Atomic …, 2011 - APS
We present a theoretical study of transient absorption and resha** of extreme ultraviolet
(XUV) pulses by helium atoms dressed with a moderately strong infrared (IR) laser field. We …

[HTML][HTML] Complex absorbing potentials within EOM-CC family of methods: Theory, implementation, and benchmarks

D Zuev, TC Jagau, KB Bravaya… - The Journal of …, 2014 - pubs.aip.org
A production-level implementation of equation-of-motion coupled-cluster singles and
doubles (EOM-CCSD) for electron attachment and excitation energies augmented by a …