Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation

Autores
Uñac, Rodolfo Omar; Vidales, Ana Maria; Zgrablich, Jorge Andres
Año de publicación
2009
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
The purpose of the present work was to study the effect of the adsorbate-adsorbate interaction energy for the glycine/Cu(110) system using a Monte Carlo simulation in the grand canonical ensemble. The dependence of the surface pattern structures upon the temperature and diffusion rate was studied. For either reversible or irreversible adsorption, the results showed that it is possible to obtain condensed phases with a large degree of correlation for high diffusion rates and temperatures. Depending on the set of interaction energies for nearest-and next-nearest-neighbour molecules, these patterns form either hetero-or homo-chiral footprint domains.The results obtained are qualitatively consistent with the experimental pattern observed by other authors and allow an interpretation of the different proposed theoretical models used to explain experimental data.
Fil: Uñac, Rodolfo Omar. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; Argentina
Fil: Vidales, Ana Maria. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; Argentina
Fil: Zgrablich, Jorge Andres. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; Argentina
Materia
MONTE CARLO
ADSORPTION
GLYCINE
Nivel de accesibilidad
acceso abierto
Condiciones de uso
https://creativecommons.org/licenses/by/2.5/ar/
Repositorio
CONICET Digital (CONICET)
Institución
Consejo Nacional de Investigaciones Científicas y Técnicas
OAI Identificador
oai:ri.conicet.gov.ar:11336/117235
Acceder
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network_acronym_str CONICETDig
repository_id_str 3498
network_name_str CONICET Digital (CONICET)
spelling Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulationUñac, Rodolfo OmarVidales, Ana MariaZgrablich, Jorge AndresMONTE CARLOADSORPTIONGLYCINEhttps://purl.org/becyt/ford/1.3https://purl.org/becyt/ford/1The purpose of the present work was to study the effect of the adsorbate-adsorbate interaction energy for the glycine/Cu(110) system using a Monte Carlo simulation in the grand canonical ensemble. The dependence of the surface pattern structures upon the temperature and diffusion rate was studied. For either reversible or irreversible adsorption, the results showed that it is possible to obtain condensed phases with a large degree of correlation for high diffusion rates and temperatures. Depending on the set of interaction energies for nearest-and next-nearest-neighbour molecules, these patterns form either hetero-or homo-chiral footprint domains.The results obtained are qualitatively consistent with the experimental pattern observed by other authors and allow an interpretation of the different proposed theoretical models used to explain experimental data.Fil: Uñac, Rodolfo Omar. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; ArgentinaFil: Vidales, Ana Maria. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; ArgentinaFil: Zgrablich, Jorge Andres. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; ArgentinaMulti-Science Publishing2009-09info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/117235Uñac, Rodolfo Omar; Vidales, Ana Maria; Zgrablich, Jorge Andres; Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation; Multi-Science Publishing; Adsorption Science & Technology; 27; 7; 9-2009; 633-6420263-6174CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/doi/10.1260/0263-6174.27.7.633info:eu-repo/semantics/altIdentifier/url/https://journals.sagepub.com/doi/10.1260/0263-6174.27.7.633info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-10-22T11:03:27Zoai:ri.conicet.gov.ar:11336/117235instacron:CONICETInstitucionalhttp://ri.conicet.gov.ar/Organismo científico-tecnológicoNo correspondehttp://ri.conicet.gov.ar/oai/requestdasensio@conicet.gov.ar; lcarlino@conicet.gov.arArgentinaNo correspondeNo correspondeNo correspondeopendoar:34982025-10-22 11:03:28.029CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
title Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
spellingShingle Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
Uñac, Rodolfo Omar
MONTE CARLO
ADSORPTION
GLYCINE
title_short Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
title_full Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
title_fullStr Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
title_full_unstemmed Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
title_sort Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation
dc.creator.none.fl_str_mv Uñac, Rodolfo Omar
Vidales, Ana Maria
Zgrablich, Jorge Andres
author Uñac, Rodolfo Omar
author_facet Uñac, Rodolfo Omar
Vidales, Ana Maria
Zgrablich, Jorge Andres
author_role author
author2 Vidales, Ana Maria
Zgrablich, Jorge Andres
author2_role author
author
dc.subject.none.fl_str_mv MONTE CARLO
ADSORPTION
GLYCINE
topic MONTE CARLO
ADSORPTION
GLYCINE
purl_subject.fl_str_mv https://purl.org/becyt/ford/1.3
https://purl.org/becyt/ford/1
dc.description.none.fl_txt_mv The purpose of the present work was to study the effect of the adsorbate-adsorbate interaction energy for the glycine/Cu(110) system using a Monte Carlo simulation in the grand canonical ensemble. The dependence of the surface pattern structures upon the temperature and diffusion rate was studied. For either reversible or irreversible adsorption, the results showed that it is possible to obtain condensed phases with a large degree of correlation for high diffusion rates and temperatures. Depending on the set of interaction energies for nearest-and next-nearest-neighbour molecules, these patterns form either hetero-or homo-chiral footprint domains.The results obtained are qualitatively consistent with the experimental pattern observed by other authors and allow an interpretation of the different proposed theoretical models used to explain experimental data.
Fil: Uñac, Rodolfo Omar. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; Argentina
Fil: Vidales, Ana Maria. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; Argentina
Fil: Zgrablich, Jorge Andres. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - San Luis. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich". Universidad Nacional de San Luis. Facultad de Ciencias Físico Matemáticas y Naturales. Instituto de Física Aplicada "Dr. Jorge Andrés Zgrablich"; Argentina
description The purpose of the present work was to study the effect of the adsorbate-adsorbate interaction energy for the glycine/Cu(110) system using a Monte Carlo simulation in the grand canonical ensemble. The dependence of the surface pattern structures upon the temperature and diffusion rate was studied. For either reversible or irreversible adsorption, the results showed that it is possible to obtain condensed phases with a large degree of correlation for high diffusion rates and temperatures. Depending on the set of interaction energies for nearest-and next-nearest-neighbour molecules, these patterns form either hetero-or homo-chiral footprint domains.The results obtained are qualitatively consistent with the experimental pattern observed by other authors and allow an interpretation of the different proposed theoretical models used to explain experimental data.
publishDate 2009
dc.date.none.fl_str_mv 2009-09
dc.type.none.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/publishedVersion
http://purl.org/coar/resource_type/c_6501
info:ar-repo/semantics/articulo
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://hdl.handle.net/11336/117235
Uñac, Rodolfo Omar; Vidales, Ana Maria; Zgrablich, Jorge Andres; Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation; Multi-Science Publishing; Adsorption Science & Technology; 27; 7; 9-2009; 633-642
0263-6174
CONICET Digital
CONICET
url http://hdl.handle.net/11336/117235
identifier_str_mv Uñac, Rodolfo Omar; Vidales, Ana Maria; Zgrablich, Jorge Andres; Effect of interaction energies on the adsorption of glycine onto a Cu(110) surface: A monte carlo simulation; Multi-Science Publishing; Adsorption Science & Technology; 27; 7; 9-2009; 633-642
0263-6174
CONICET Digital
CONICET
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/doi/10.1260/0263-6174.27.7.633
info:eu-repo/semantics/altIdentifier/url/https://journals.sagepub.com/doi/10.1260/0263-6174.27.7.633
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
https://creativecommons.org/licenses/by/2.5/ar/
eu_rights_str_mv openAccess
rights_invalid_str_mv https://creativecommons.org/licenses/by/2.5/ar/
dc.format.none.fl_str_mv application/pdf
application/pdf
application/pdf
application/pdf
dc.publisher.none.fl_str_mv Multi-Science Publishing
publisher.none.fl_str_mv Multi-Science Publishing
dc.source.none.fl_str_mv reponame:CONICET Digital (CONICET)
instname:Consejo Nacional de Investigaciones Científicas y Técnicas
reponame_str CONICET Digital (CONICET)
collection CONICET Digital (CONICET)
instname_str Consejo Nacional de Investigaciones Científicas y Técnicas
repository.name.fl_str_mv CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicas
repository.mail.fl_str_mv dasensio@conicet.gov.ar; lcarlino@conicet.gov.ar
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score 12.982451

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