Carbon monoxide adsorption on molybdenum phosphides: Fourier transform infrared spectroscopic and density functional theory studies

Article Abstract:

Molybdenum phosphide (MoP) and supported molybdenum phosphide (MoP/gamma-Al2O3) are prepared and characterized by the temperature-programmed reduction method. Co that is observed to get adsorbed on the surface of MoP/Al2O3 shows a characteristic band at ~2037 per cm because of the linearly adsorbed CO on Mo(super delta+) sites.

United States, Observations, Adsorption

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Density functional theory study of triangular molybdenum sulfide nanocluster and CO adsorption on it

Article Abstract:

A systematic density functional study on the structure and stability of triangular molybdenum sulfide [MoS(sub x)] models is carried out. It is found that CO adsorption at the corner site represents the most stable conformation.

Chemical properties

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Density functional theory study of CO adsorption on molybdenum sulfide

Article Abstract:

CO adsorption on four MoSx clusters is investigated by using density functional method. It is found that CO prefers adsorption on the coordinatively unsaturated (1010) surface.

Germany, Usage

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