First-principles calculation of core-level binding energy shift in surface chemical processes

2010 ◽  
Vol 53 (2) ◽  
pp. 402-410 ◽  
Author(s):  
ZhenHua Zeng ◽  
XiuFang Ma ◽  
WuChen Ding ◽  
WeiXue Li
Keyword(s):  
Binding Energy ◽  
First Principles ◽  
Energy Shift ◽  
Chemical Processes ◽  
Core Level ◽  
First Principles Calculation ◽  
Surface Chemical ◽  
Binding Energy Shift ◽  
Core Level Binding Energy

Core-level binding energy shift as a probe of morphological changes in two-dimensionalAg−Coalloy

2006 ◽  
Vol 73 (19) ◽  
Author(s):  
P. J. Godowski ◽  
J. Onsgaard ◽  
M. Trzebiatowska-Gusowska ◽  
K. Pater ◽  
Z. S. Li
Keyword(s):  
Binding Energy ◽  
Morphological Changes ◽  
Energy Shift ◽  
Core Level ◽  
Binding Energy Shift ◽  
Core Level Binding Energy

scholarly journals Core electron binding energies of adsorbates on Cu(111) from first-principles calculations

2018 ◽  
Vol 20 (48) ◽  
pp. 30403-30411 ◽  
Author(s):  
J. Matthias Kahk ◽  
Johannes Lischner
Keyword(s):  
Binding Energy ◽  
First Principles ◽  
Binding Energies ◽  
Core Level ◽  
First Principles Calculations ◽  
Core Electron ◽  
Core Level Binding Energy ◽  
Electron Binding Energies ◽  
Electron Binding

C1s and O1s core level binding energy shifts have been calculated for various adsorbates on Cu(111) using the ΔSCF method.

Soft X-ray Si 2p core-level spectra of H8Si8O12 physisorbed on Si(111)-H: additional experimental evidence regarding the binding energy shift of the HSi03 fragment

1996 ◽  
Vol 446 ◽  
Author(s):  
K. Z. Zhang ◽  
Mark M. Banaszak Holl ◽  
F. R. McFeely
Keyword(s):  
Binding Energy ◽  
Experimental Evidence ◽  
Strong Support ◽  
Energy Shift ◽  
Core Level ◽  
X Ray ◽  
Binding Energy Shift

AbstractThe hydridospherosiloxane cluster H8Si8012 has been physisorbed onto Si(111)-H and soft X-ray Si 2p core-level photoemission spectra obtained. The results of these experiments provide strong support for previous binding energy assignments of HSi03 moieties at -3.6 eV.

HIGH RESOLUTION CORE LEVEL SPECTROSCOPY AT THE Cu/Ru(0001) INTERFACE

2002 ◽  
Vol 09 (02) ◽  
pp. 723-727 ◽  
Author(s):  
T. H. ANDERSEN ◽  
L. BECH ◽  
J. ONSGAARD ◽  
S. V. HOFFMANN ◽  
Z. LI
Keyword(s):  
High Resolution ◽  
Synchrotron Radiation ◽  
Binding Energy ◽  
Energy Shift ◽  
Core Level ◽  
Photoemission Spectroscopy ◽  
Copper Adsorption ◽  
X Ray ◽  
Level Shifts ◽  
Binding Energy Shift

Copper adsorption on Ru(0001) has been studied by synchrotron radiation. The clean Ru 3d 5/2 spectra were found to consist of two components with a binding energy shift of 400 meV. The component with the lower binding energy represents the first layer of ruthenium atoms. Adsorption of copper gives rise to core level shifts of the Ru 3d 5/2 components, which were studied as a function of Cu coverage. Experiments were carried out with copper coverages varying from the submonolayer range up to two monolayers of copper. The binding energy of the Cu 2p 3/2 level was measured by X-ray photoemission spectroscopy.

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