Quantum mechanics capacitance molecular mechanics modeling of core-electron binding energies of methanol and methyl nitrite on Ag(111) surface-Reference-Cited by-同舟云学术

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Quantum mechanics capacitance molecular mechanics modeling of core-electron binding energies of methanol and methyl nitrite on Ag(111) surface

Published:2016-07-14 Issue:2 Volume:145 Page:024703
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Löytynoja T.¹²^ORCID,Li X.²,Jänkälä K.¹,Rinkevicius Z.²³,Ågren H.²

Affiliation:

1. Nano and Molecular Systems Research Unit, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland

2. Division of Theoretical Chemistry and Biology, School of Biotechnology, Royal Institute of Technology, SE-106 91 Stockholm, Sweden

3. Swedish e-Science Research Centre (SeRC), KTH Royal Institute of Technology, SE-100 44 Stockholm, Sweden

Funder

University of Oulu Graduate School

Vilho, Yrjö and Kalle Väisälä Foundation

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4956449

Reference38 articles.

1. Chemical Shift Effect in Inner Electronic Levels of Cu Due to Oxidation

2. Interaction between theory and experiment in molecular core electron spectroscopies

3. Self-Consistent-Field Wave Functions for Hole States of Some Ne-Like and Ar-Like Ions

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