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• W2016677584 endingPage "17180" @default.
• W2016677584 startingPage "17168" @default.
• W2016677584 abstract "The (initial state) core-level shifts of transition metals in bulk alloys and for bimetallic adlayer systems are calculated and analyzed in terms of extra- and (l-decomposed) intra-atomic contributions. Both the trends and magitudes of the calculated shifts are consistent with experimental data where they exist. Core-level shifts of the same sign for both constituents are common in both alloy and adlayer systems. The commonly used ``charge transfer'' model for interpreting core-level shifts is shown to be grossly inadequate, especially for describing the adlayer shifts; for bulk alloys, however, there is a correlation between the shifts and the changes in the d electron count. The results support the view that the bonding in bulk alloys and adlayers is fundamentally the same; in particular, there is no evidence for any anomalous charge transfer in adlayer systems. The extra-atomic contributions to the adlayer shifts are found to dominate the total shifts for Cu/Rh(001), Cu/Ta(110), and Pd/Ta(110), with the intra-atomic contributions often having the opposite sign compared to the total shift. For the substrate, however, the intra-atomic contributions are relatively more important, suggesting that substrate core-level shifts may provide a better measure of the local chemical effects than adlayer shifts. The relationship of core-level shifts to other physical properties is also discussed." @default.
• W2016677584 created "2016-06-24" @default.
• W2016677584 creator A5050085483 @default.
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• W2016677584 date "1995-06-15" @default.
• W2016677584 modified "2023-10-16" @default.
• W2016677584 title "Core-level shifts in bulk alloys and surface adlayers" @default.
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• W2016677584 doi "https://doi.org/10.1103/physrevb.51.17168" @default.
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