Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures
Autor(a) principal: | |
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Data de Publicação: | 2006 |
Outros Autores: | , |
Tipo de documento: | Artigo |
Idioma: | eng |
Título da fonte: | Repositório Institucional da UFRGS |
Texto Completo: | http://hdl.handle.net/10183/204970 |
Resumo: | An investigation of the molecular dynamics in pure liquids and in mixtures through the technique of time resolved optical Kerr effect is performed. The samples studied were the mixtures of carbon disulfide (CS2) with benzene (C6H6). The molecular dynamics of the pure liquids is briefly discussed while the main results are obtained for the mixtures. A slow dynamics component is observed for the optical heterodyne detected optical Kerr effect transient decaying exponentially with time constants on picosecond time scale. The fast subpicosend time relaxations are analyzed in terms of the nondiffusive component of the spectral response that is associated with the molecular dynamics. The modifications of the spectrum are quantified, and the explanation of the observed changes is given in terms of the structural interaction configurations that produced changes in the intermolecular potential within which the molecules execute librational motions. |
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Heisler, Ismael AndreCorreia, Ricardo Rego BordaloCunha, Silvio Luiz Souza2020-01-28T04:11:05Z20060021-9606http://hdl.handle.net/10183/204970000575801An investigation of the molecular dynamics in pure liquids and in mixtures through the technique of time resolved optical Kerr effect is performed. The samples studied were the mixtures of carbon disulfide (CS2) with benzene (C6H6). The molecular dynamics of the pure liquids is briefly discussed while the main results are obtained for the mixtures. A slow dynamics component is observed for the optical heterodyne detected optical Kerr effect transient decaying exponentially with time constants on picosecond time scale. The fast subpicosend time relaxations are analyzed in terms of the nondiffusive component of the spectral response that is associated with the molecular dynamics. The modifications of the spectrum are quantified, and the explanation of the observed changes is given in terms of the structural interaction configurations that produced changes in the intermolecular potential within which the molecules execute librational motions.application/pdfengThe journal of chemical physics. New York. Vol. 125, no. 18 (Nov. 2006), 184503, 7 p.Efeito kerr oticoDinâmica molecularMolecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixturesEstrangeiroinfo:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/openAccessreponame:Repositório Institucional da UFRGSinstname:Universidade Federal do Rio Grande do Sul (UFRGS)instacron:UFRGSTEXT000575801.pdf.txt000575801.pdf.txtExtracted Texttext/plain32104http://www.lume.ufrgs.br/bitstream/10183/204970/2/000575801.pdf.txte4c55dc51b96f737b54a90ae1b87c187MD52ORIGINAL000575801.pdfTexto completo (inglês)application/pdf623728http://www.lume.ufrgs.br/bitstream/10183/204970/1/000575801.pdfd2ed2fac53bfc0dfc7ce4b3c80e031aaMD5110183/2049702023-08-04 03:31:50.002901oai:www.lume.ufrgs.br:10183/204970Repositório de PublicaçõesPUBhttps://lume.ufrgs.br/oai/requestopendoar:2023-08-04T06:31:50Repositório Institucional da UFRGS - Universidade Federal do Rio Grande do Sul (UFRGS)false |
dc.title.pt_BR.fl_str_mv |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
title |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
spellingShingle |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures Heisler, Ismael Andre Efeito kerr otico Dinâmica molecular |
title_short |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
title_full |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
title_fullStr |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
title_full_unstemmed |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
title_sort |
Molecular dynamics investigation with the time resolved optical Kerr effect on the CS2–C6H6 mixtures |
author |
Heisler, Ismael Andre |
author_facet |
Heisler, Ismael Andre Correia, Ricardo Rego Bordalo Cunha, Silvio Luiz Souza |
author_role |
author |
author2 |
Correia, Ricardo Rego Bordalo Cunha, Silvio Luiz Souza |
author2_role |
author author |
dc.contributor.author.fl_str_mv |
Heisler, Ismael Andre Correia, Ricardo Rego Bordalo Cunha, Silvio Luiz Souza |
dc.subject.por.fl_str_mv |
Efeito kerr otico Dinâmica molecular |
topic |
Efeito kerr otico Dinâmica molecular |
description |
An investigation of the molecular dynamics in pure liquids and in mixtures through the technique of time resolved optical Kerr effect is performed. The samples studied were the mixtures of carbon disulfide (CS2) with benzene (C6H6). The molecular dynamics of the pure liquids is briefly discussed while the main results are obtained for the mixtures. A slow dynamics component is observed for the optical heterodyne detected optical Kerr effect transient decaying exponentially with time constants on picosecond time scale. The fast subpicosend time relaxations are analyzed in terms of the nondiffusive component of the spectral response that is associated with the molecular dynamics. The modifications of the spectrum are quantified, and the explanation of the observed changes is given in terms of the structural interaction configurations that produced changes in the intermolecular potential within which the molecules execute librational motions. |
publishDate |
2006 |
dc.date.issued.fl_str_mv |
2006 |
dc.date.accessioned.fl_str_mv |
2020-01-28T04:11:05Z |
dc.type.driver.fl_str_mv |
Estrangeiro info:eu-repo/semantics/article |
dc.type.status.fl_str_mv |
info:eu-repo/semantics/publishedVersion |
format |
article |
status_str |
publishedVersion |
dc.identifier.uri.fl_str_mv |
http://hdl.handle.net/10183/204970 |
dc.identifier.issn.pt_BR.fl_str_mv |
0021-9606 |
dc.identifier.nrb.pt_BR.fl_str_mv |
000575801 |
identifier_str_mv |
0021-9606 000575801 |
url |
http://hdl.handle.net/10183/204970 |
dc.language.iso.fl_str_mv |
eng |
language |
eng |
dc.relation.ispartof.pt_BR.fl_str_mv |
The journal of chemical physics. New York. Vol. 125, no. 18 (Nov. 2006), 184503, 7 p. |
dc.rights.driver.fl_str_mv |
info:eu-repo/semantics/openAccess |
eu_rights_str_mv |
openAccess |
dc.format.none.fl_str_mv |
application/pdf |
dc.source.none.fl_str_mv |
reponame:Repositório Institucional da UFRGS instname:Universidade Federal do Rio Grande do Sul (UFRGS) instacron:UFRGS |
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Universidade Federal do Rio Grande do Sul (UFRGS) |
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UFRGS |
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UFRGS |
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Repositório Institucional da UFRGS |
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Repositório Institucional da UFRGS |
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