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dc.contributor.authorLu, X
dc.contributor.author吕鑫
dc.contributor.authorXu, X
dc.contributor.author徐昕
dc.contributor.authorWang, NQ
dc.contributor.author王南钦
dc.contributor.authorZhang, QE
dc.contributor.author张乾二
dc.date.accessioned2012-10-04T02:18:31Z
dc.date.available2012-10-04T02:18:31Z
dc.date.issued1995
dc.identifier.citationCHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE,1995,16(11):1757-1760zh_CN
dc.identifier.issn0251-0790
dc.identifier.urihttps://dspace.xmu.edu.cn/handle/2288/13677
dc.description.abstractChemisorptions of oxygen species on cation site of NiO(100) surface have been studied by means of DV-Xa embedded cluster model calculations, Calculational results show that: i) Adsorption of molecular O-2 species results in an adsorption state of O-2(delta-), which subsequently faciliates the dissociation oi the O-O bond to give rise to an O- adspecies ii) the adsorptions of all the investigated oxygen species increase the oxide state of the cations.zh_CN
dc.language.isozhzh_CN
dc.publisherHIGHER EDUCATION PRESSzh_CN
dc.subjectoxygen adspecieszh_CN
dc.subjectNiO(100) surfacezh_CN
dc.subjectembedded cluster DV-X alphazh_CN
dc.subjectadsorption-induced oxidation of cationzh_CN
dc.titleDV-X alpha embedded cluster studies: Chemisorption of oxygen species on NiO(100) surfacezh_CN
dc.typeArticlezh_CN


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