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Computer simulation of hole distribution in polymeric materials

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Resumo:Polymers have been known for their flexibility and easy processing into coatings and films, which made them suitable to be applied in a variety of areas and in particular the growing area of organic electronics. The electronic properties of semiconducting polymers made them a serious rival in areas where until now inorganic materials were the most used, such as light emitting diodes or solar cells. Typical polymers can be seen as a network of molecular strands of varied lengths and orientations, with a random distribution of physical and chemical defects which makes them an anisotropic material. To further increase their performance, a better understanding of all aspects related to charge transport and space charge distribution in polymeric materials is required. The process associated with charge transport depends on the properties of the polymer molecules as well as connectivity and texture, and so we adopt a mesoscopic approach to build polymer structures. Changing the potential barrier for charge injection we can introduce holes in the polymer network and, by using a generalised Monte-Carlo method, we can simulate the transport of the injected charge through the polymer layer caused by imposing a voltage between two planar electrodes. Our results show that the way that holes distribute within polymer layer and charge localization in these materials is quite different from the inorganic ones.
Autores principais:Barbosa, Helder M. C.
Outros Autores:Ramos, Marta M. D.
Assunto:Mesoscopic modelling PPV Polymer morphology Space charge distribution
Ano:2008
País:Portugal
Tipo de documento:comunicação em conferência
Tipo de acesso:acesso aberto
Instituição associada:Universidade do Minho
Idioma:inglês
Origem:RepositóriUM - Universidade do Minho
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author Barbosa, Helder M. C.
author2 Ramos, Marta M. D.
author2_role author
author_facet Barbosa, Helder M. C.
Ramos, Marta M. D.
author_role author
contributor_name_str_mv RepositóriUM - Universidade do Minho
country_str PT
creators_json_txt [{\"Person.name\":\"Barbosa, Helder M. C.\"},{\"Person.name\":\"Ramos, Marta M. D.\"}]
datacite.contributors.contributor.contributorName.fl_str_mv RepositóriUM - Universidade do Minho
datacite.creators.creator.creatorName.fl_str_mv Barbosa, Helder M. C.
Ramos, Marta M. D.
datacite.date.Accepted.fl_str_mv 2008-06-01T00:00:00Z
datacite.date.available.fl_str_mv 2009-01-12T16:48:11Z
datacite.date.embargoed.fl_str_mv 2009-01-12T16:48:11Z
datacite.rights.fl_str_mv http://purl.org/coar/access_right/c_abf2
datacite.subjects.subject.fl_str_mv Mesoscopic modelling
PPV
Polymer morphology
Space charge distribution
datacite.titles.title.fl_str_mv Computer simulation of hole distribution in polymeric materials
dc.contributor.none.fl_str_mv RepositóriUM - Universidade do Minho
dc.creator.none.fl_str_mv Barbosa, Helder M. C.
Ramos, Marta M. D.
dc.date.Accepted.fl_str_mv 2008-06-01T00:00:00Z
dc.date.available.fl_str_mv 2009-01-12T16:48:11Z
dc.date.embargoed.fl_str_mv 2009-01-12T16:48:11Z
dc.format.none.fl_str_mv application/pdf
dc.identifier.none.fl_str_mv https://hdl.handle.net/1822/8559
dc.language.none.fl_str_mv eng
dc.publisher.none.fl_str_mv Trans Tech Publications
dc.rights.none.fl_str_mv http://purl.org/coar/access_right/c_abf2
dc.subject.none.fl_str_mv Mesoscopic modelling
PPV
Polymer morphology
Space charge distribution
dc.title.fl_str_mv Computer simulation of hole distribution in polymeric materials
dc.type.none.fl_str_mv http://purl.org/coar/resource_type/c_5794
description Polymers have been known for their flexibility and easy processing into coatings and films, which made them suitable to be applied in a variety of areas and in particular the growing area of organic electronics. The electronic properties of semiconducting polymers made them a serious rival in areas where until now inorganic materials were the most used, such as light emitting diodes or solar cells. Typical polymers can be seen as a network of molecular strands of varied lengths and orientations, with a random distribution of physical and chemical defects which makes them an anisotropic material. To further increase their performance, a better understanding of all aspects related to charge transport and space charge distribution in polymeric materials is required. The process associated with charge transport depends on the properties of the polymer molecules as well as connectivity and texture, and so we adopt a mesoscopic approach to build polymer structures. Changing the potential barrier for charge injection we can introduce holes in the polymer network and, by using a generalised Monte-Carlo method, we can simulate the transport of the injected charge through the polymer layer caused by imposing a voltage between two planar electrodes. Our results show that the way that holes distribute within polymer layer and charge localization in these materials is quite different from the inorganic ones.
dirty 0
eu_rights_str_mv openAccess
format conferencePaper
fulltext.url.fl_str_mv https://repositorium.uminho.pt/bitstreams/e6f41d1f-caa4-485a-be9b-38053a8006e9/download
id rum_b200201fcc1cff4c3c3bc23ef4e3cfaf
identifier.url.fl_str_mv https://hdl.handle.net/1822/8559
instacron_str repositorium
institution Universidade do Minho
instname_str Universidade do Minho
language eng
network_acronym_str rum
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oai_identifier_str oai:repositorium.uminho.pt:1822/8559
organization_str_mv urn:organizationAcronym:repositorium
person_str_mv Barbosa, Helder M. C.
Ramos, Marta M. D.
publishDate 2008
publisher.none.fl_str_mv Trans Tech Publications
reponame_str RepositóriUM - Universidade do Minho
repository_id_str urn:repositoryAcronym:rum
service_str_mv urn:repositoryAcronym:rum
spelling engTrans Tech PublicationsenPolymers have been known for their flexibility and easy processing into coatings and films, which made them suitable to be applied in a variety of areas and in particular the growing area of organic electronics. The electronic properties of semiconducting polymers made them a serious rival in areas where until now inorganic materials were the most used, such as light emitting diodes or solar cells. Typical polymers can be seen as a network of molecular strands of varied lengths and orientations, with a random distribution of physical and chemical defects which makes them an anisotropic material. To further increase their performance, a better understanding of all aspects related to charge transport and space charge distribution in polymeric materials is required. The process associated with charge transport depends on the properties of the polymer molecules as well as connectivity and texture, and so we adopt a mesoscopic approach to build polymer structures. Changing the potential barrier for charge injection we can introduce holes in the polymer network and, by using a generalised Monte-Carlo method, we can simulate the transport of the injected charge through the polymer layer caused by imposing a voltage between two planar electrodes. Our results show that the way that holes distribute within polymer layer and charge localization in these materials is quite different from the inorganic ones.application/pdfenComputer simulation of hole distribution in polymeric materialsBarbosa, Helder M. C.Ramos, Marta M. D.HostingInstitutionOrganizationalRepositóriUM - Universidade do Minhoe-mailmailto:repositorium@usdb.uminho.ptrepositorium@usdb.uminho.ptCITATION"Materials Science Forum." ISSN 0255-5476. 587-588 (Jun. 2008) 711-715.ISSNIsPartOf0255-54762009-01-12T16:48:11Z2008-062008-06-01T00:00:00ZHandlehttps://hdl.handle.net/1822/8559http://purl.org/coar/access_right/c_abf2open accessMesoscopic modellingPPVPolymer morphologySpace charge distribution1019154 bytesother research producthttp://purl.org/coar/resource_type/c_5794conference paperhttp://purl.org/coar/access_right/c_abf2application/pdffulltexthttps://repositorium.uminho.pt/bitstreams/e6f41d1f-caa4-485a-be9b-38053a8006e9/download
spellingShingle Computer simulation of hole distribution in polymeric materials
Barbosa, Helder M. C.
Mesoscopic modelling
PPV
Polymer morphology
Space charge distribution
status SINGLETON
subject.fl_str_mv Mesoscopic modelling
PPV
Polymer morphology
Space charge distribution
title Computer simulation of hole distribution in polymeric materials
title_full Computer simulation of hole distribution in polymeric materials
title_fullStr Computer simulation of hole distribution in polymeric materials
title_full_unstemmed Computer simulation of hole distribution in polymeric materials
title_short Computer simulation of hole distribution in polymeric materials
title_sort Computer simulation of hole distribution in polymeric materials
topic Mesoscopic modelling
PPV
Polymer morphology
Space charge distribution
topic_facet Mesoscopic modelling
PPV
Polymer morphology
Space charge distribution
url https://hdl.handle.net/1822/8559
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