Empirical density functional and the adsorption of organic molecules on Si(100)
Ab initio computational chemistry is finding increased use in the field of surface science, particularly in the study of adsorption. For semiconductor surfaces, such studies typically employ cluster models of the substrate. However, computational expense
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|Source:||Physical Review B: Condensed Matter and Materials|
|01_Phillips_Empirical_density_functional_2003.pdf||546.7 kB||Adobe PDF||Request a copy|
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