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Theory of CO adsorption on Co{1 0 1̄ 0}

✍ Scribed by S.J. Jenkins; D.A. King


Book ID
117216502
Publisher
Elsevier Science
Year
2002
Tongue
English
Weight
131 KB
Volume
504
Category
Article
ISSN
0039-6028

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DFT calculations have been performed to investigate the effect of dielectric responses of the solvent environment on the CO adsorption over CuCl(1 1 1) surface by using COSMO (conductor-like solvent model) model in Dmol 3 . Different dielectric constants, including vacuum, liquid paraffin, methylene