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The adsorptions of formaldehyde molecule on the stoichiometric anatase TiO 2 (101) surface have been studied by first principles calculations. Four types of adsorption have been investigated at 0.25 ML coverage. Two of them are chemical adsorptions and the other two are physical adsorptions. For the chemical adsorptions, C, O atoms in the formaldehyde molecule form two bonds with the O ...
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