A theoretical quantum study on the distribution of electrophilic and nucleophilic active sites on Ag(100) surfaces modeled as Finite Clusters
A theoretical quantum study on the distribution of electrophilicand nucleophilic active sites on silver surfaces with (100)orientation and modeled as finite clusters is reported. From Hartree-Fock and Density Functional Theory calculations with theLANL1MB and LANL2DZ basis set, we found that the ele...
Wedi'i Gadw mewn:
| Cyhoeddwyd yn: | Journal of the Mexican Chemical Society |
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| Prif Awduron: | , , |
| Fformat: | Artigo |
| Iaith: | Inglês |
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Sociedad Química de México
2006
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| Pynciau: | |
| Mynediad Ar-lein: | https://www.redalyc.org/articulo.oa?id=47550105 |
| Tagiau: |
Dim Tagiau, Byddwch y cyntaf i dagio'r cofnod hwn!
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