Influence of surface reaction rate on the size dispersion of interfacial nanostructures

Article Abstract:

A generic framework to incorporate a finite reaction rate between the free particle and the nucleation site is investigated. The results show that three-dimensional BD simulations for the influence of surface reaction rate on the development size dispersion of interfacial structures are formed by instantaneous nucleation and grow on substrates with randomly distributed nucleation sites.

Nucleation, Nucleation (Chemistry)

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Surface structure at hexadecane and halo-hexadecane liquid/vapor interfaces

Article Abstract:

The effect of end group dipoles and endgroup size on surface structure by comparing surface vibrational spectra of n-hexadecane (n-C16) to those of 1-chlorohexadecane (C1-C16) and 1-bromohexadecane (Br-C16) is investigated. According to the demonstration, small changes in molecular structure can have a profound impact on the surface structure at a liquid/vapor interface,

Comparative analysis, Molecular structure, Vibrational spectra

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Comment on 'orbital interactions between a C60 molecule and Cu(111) surface'

Article Abstract:

The interaction between Cu clusters and C60 molecule are examined to elucidate the nature of the C60-Cu(111) bonding and the orientational configuration of a C60 molecule on a Cu surface. The results indicate that basis set superposition error (BSSE) are considerable, even with density functional calculations, using such minimal basis sets.

Molecules

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