A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters
The development and reconstruction of surface structures formed by underpotential deposition (UPD) of Cu atoms on Pt(100) and Pt(111) clusters are approached through extended Hückel molecular orbital (EHMO) calculations applied to a statistical Cu atom deposition. These results allow us to obtain a...
Guardado en:
Autores principales: | , , , |
---|---|
Formato: | Articulo |
Lenguaje: | Inglés |
Publicado: |
1992
|
Materias: | |
Acceso en línea: | http://sedici.unlp.edu.ar/handle/10915/118683 |
Aporte de: |
id |
I19-R120-10915-118683 |
---|---|
record_format |
dspace |
institution |
Universidad Nacional de La Plata |
institution_str |
I-19 |
repository_str |
R-120 |
collection |
SEDICI (UNLP) |
language |
Inglés |
topic |
Ciencias Exactas Química Extended Hückel molecular orbital Copper electrodeposits |
spellingShingle |
Ciencias Exactas Química Extended Hückel molecular orbital Copper electrodeposits López, M. B. Estiú, Guillermina Castro, Eduardo Alberto Arvia, Alejandro Jorge A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters |
topic_facet |
Ciencias Exactas Química Extended Hückel molecular orbital Copper electrodeposits |
description |
The development and reconstruction of surface structures formed by underpotential deposition (UPD) of Cu atoms on Pt(100) and Pt(111) clusters are approached through extended Hückel molecular orbital (EHMO) calculations applied to a statistical Cu atom deposition. These results allow us to obtain a qualitative description of the different stable configurations of Cu atoms on the Pt cluster surfaces in terms of the corresponding binding energies. |
format |
Articulo Articulo |
author |
López, M. B. Estiú, Guillermina Castro, Eduardo Alberto Arvia, Alejandro Jorge |
author_facet |
López, M. B. Estiú, Guillermina Castro, Eduardo Alberto Arvia, Alejandro Jorge |
author_sort |
López, M. B. |
title |
A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters |
title_short |
A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters |
title_full |
A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters |
title_fullStr |
A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters |
title_full_unstemmed |
A semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on Pt(100) and Pt(111) clusters |
title_sort |
semiempirical quantum approach to possible structures of copper electrodeposits at submonolayer and monolayer levels on pt(100) and pt(111) clusters |
publishDate |
1992 |
url |
http://sedici.unlp.edu.ar/handle/10915/118683 |
work_keys_str_mv |
AT lopezmb asemiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT estiuguillermina asemiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT castroeduardoalberto asemiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT arviaalejandrojorge asemiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT lopezmb semiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT estiuguillermina semiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT castroeduardoalberto semiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters AT arviaalejandrojorge semiempiricalquantumapproachtopossiblestructuresofcopperelectrodepositsatsubmonolayerandmonolayerlevelsonpt100andpt111clusters |
bdutipo_str |
Repositorios |
_version_ |
1764820447462948865 |