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  Initial and final state contributions to binding-energy shifts due to lattice strain: Validation of Auger parameter analyses

Bagus, P. S., Wieckowski, A., & Freund, H.-J. (2006). Initial and final state contributions to binding-energy shifts due to lattice strain: Validation of Auger parameter analyses. Chemical Physics Letters, 420(1-3), 42-46. doi:10.1016/j.cplett.2005.12.033.

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738215.pdf (Correspondence), 856KB
 
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Bagus, Paul S., Author
Wieckowski, Andrzej, Author
Freund, Hans-Joachim1, Author           
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1Chemical Physics, Fritz Haber Institute, Max Planck Society, ou_24022              

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 Abstract: The validity of Auger parameter analyses to separate initial and final state contributions to core-level binding energy shifts in the growth of nanoparticles is tested; the specific concern is shifts due to lattice strain. Theoretical energies for the hole-states involved are used to avoid the approximations and assumptions normally required to justify the analyses. When the Auger transitions involve states with high lying d-holes, the Auger parameter analysis of the origin of the shifts is incorrect. When only core–hole Auger states are used, a suitable formulation will accurately reproduce the initial state origin of shifts due to lattice strain.

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Title: Chemical Physics Letters
  Alternative Title : Chem. Phys. Lett.
Source Genre: Journal
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Pages: - Volume / Issue: 420 (1-3) Sequence Number: - Start / End Page: 42 - 46 Identifier: -