Multi-electron excitation contributions towards primary and satellite states in the photoelectron spectrum-Reference-Cited by-同舟云学术

Multi-electron excitation contributions towards primary and satellite states in the photoelectron spectrum

Published:2022 Issue:14 Volume:24 Page:8329-8343
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Moitra Torsha¹^ORCID,Paul Alexander C.²^ORCID,Decleva Piero³^ORCID,Koch Henrik²⁴^ORCID,Coriani Sonia¹²^ORCID

Affiliation:

1. DTU Chemistry, Technical University of Denmark, DK-2800 Kongens Lyngby, Denmark

2. Department of Chemistry, NTNU – Norwegian University of Science and Technology, N-7491 Trondheim, Norway

3. Istituto Officina dei Materiali IOM-CNR and Dipartimento di Scienze Chimiche e Farmaceutiche, Università degli Studi di Trieste, I-34121 Trieste, Italy

4. Scuola Normale Superiore, I-56126 Pisa, Italy

Abstract

The computation of Dyson orbitals and corresponding ionization energies has been implemented within the equation of motion coupled cluster singles, doubles and perturbative triples (EOM-CC3) method.

Funder

European Cooperation in Science and Technology

Natur og Univers, Det Frie Forskningsråd

Norges Forskningsråd

H2020 Marie Skłodowska-Curie Actions

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D1CP04695K

Reference97 articles.

1. F.Merkt , S.Willitsch and U.Hollenstein , High-resolution Photoelectron Spectroscopy , in Handbook of High-resolution Spectroscopy , ed. M. Quack and F. Merkt , John Wiley & Sons, Ltd , 2011

2. Attosecond Electron Dynamics in Molecules

3. Theory of core‐level photoemission correlation state spectra

4. Dynamical photoionization observables of the CS molecule: The role of electron correlation

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