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タイトルSulfur at nickel-alumina interfaces - Molecular orbital theory
著者(英)Anderson, Alfred B.; Hong, S. Y.; Smialek, James L.
著者所属(英)Case Western Reserve Univ.|NASA Lewis Research Center
発行日1990-01-01
言語eng
内容記述Previous studies on Al-Ni alloys containing sulfur as an impurity suggest that, when S is in the interface between a metal and an oxide scale, it weakens the chemical bonding between them. This paper investigates factors responsible for this effect, using a molecular orbital theory to predict sulfur structures and electronic properties on the Ni-Al2O3 interface. It is shown that, in absence of S, the basal plane of Al2O3 will bind strongly through the Al(3+) cation surface to Ni (111). When segregated S impurity is present on the Ni surface, there are too few interfacial AlS bonds to effect good adhesion, leading to an inhibition of the oxide scale adhesion in NiCrAl alloys.
NASA分類INORGANIC AND PHYSICAL CHEMISTRY
レポートNO91A12925
E-5766
権利Copyright
URIhttps://repository.exst.jaxa.jp/dspace/handle/a-is/268589


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