Chemisorption of hydrogen and oxygen ato
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Ole Swang; Knut Faegri Jr.; Odd Gropen; Ulf Wahlgren
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Article
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1996
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John Wiley and Sons
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English
⚖ 618 KB
The chemisorption of atomic hydrogen and oxygen on a cobalt surface has been studied on a five-atom cluster model using one-electron effective core potential ( l e -E c p ) and all-electron calculations at the ab initio SCF and MCPF levels. Also, density functional calculations have been carried out