Density functional study of hypophosphite adsorption on Ni (111) and Cu (111) surfaces

Yue Zeng; Shubin Liu; Lihui Ou; Jianlong Yi; Shanci Yu; Huixian Wang; Xiaoming Xiao

doi:10.1016/j.apsusc.2005.03.211

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Density functional study of hypophosphite adsorption on Ni (111) and Cu (111) surfaces

Yue Zeng Shubin Liu Lihui Ou Jianlong Yi Shanci Yu Huixian Wang Xiaoming Xiao

Year: 2005 Journal: Applied Surface Science Vol: 252 (8)Pages: 2692-2701 Publisher: Elsevier BV

DOI: 10.1016/j.apsusc.2005.03.211

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Keywords:

Hypophosphite Mulliken population analysis Adsorption Atom (system on chip) Lone pair Crystallography Density functional theory Cluster (spacecraft) Transition metal Atomic orbital Population Molecular orbital Chemistry Metal Materials science Chemical physics Computational chemistry Electron Inorganic chemistry Physical chemistry Metallurgy Molecule Physics Organic chemistry

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Iron oxide chemistry and applications

Physical Sciences → Energy → Renewable Energy, Sustainability and the Environment

Advanced oxidation water treatment

Physical Sciences → Environmental Science → Water Science and Technology

Advanced Photocatalysis Techniques

Physical Sciences → Energy → Renewable Energy, Sustainability and the Environment

Density functional study of hypophosphite adsorption on Ni (111) and Cu (111) surfaces

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