Limitations of the equivalent core model for understanding core-level spectroscopies-Reference-Cited by-同舟云学术

Limitations of the equivalent core model for understanding core-level spectroscopies

Published:2020 Issue:39 Volume:22 Page:22617-22626
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Bagus Paul S.¹²³⁴^ORCID,Sousa Carmen⁵⁶⁷⁸,Illas Francesc⁵⁶⁷⁸^ORCID

Affiliation:

1. Department of Chemistry

2. University of North Texas

3. Denton

4. USA

5. Departament de Ciència de Materials i Química Física & Institut de Química Teòrica i Computacional (IQTCUB)

6. Universitat de Barcelona

7. 08028 Barcelona

8. Spain

Abstract

Differences when the ionized, blue, atom is represented with a core-hole or with a Z + 1 equivalent core are explored.

Funder

U.S. Department of Energy

Generalitat de Catalunya

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP03569F

Reference76 articles.

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3. The core electron binding energies of oxygen difluoride

4. Surface heat of segregation from surface core-level binding-energy shifts

5. Core-level binding-energy shifts for the metallic elements

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