Effects of three-body interactions on structural phases of classical twodimensional cluster

Detalhes bibliográficos
Autor(a) principal: CORREIA, Matheus Valença
Data de Publicação: 2021
Tipo de documento: Dissertação
Idioma: eng
Título da fonte: Repositório Institucional da UFPE
Texto Completo: https://repositorio.ufpe.br/handle/123456789/41391
Resumo: When a physical system has many interacting constituents, many-body terms will arise in the Hamiltonian, besides the usual two-body interactions. These terms are often ignored in numerical studies due to their high computational cost. However, many-body terms are responsible for important corrections in charged colloidal systems and promote structural changes in clusters of Abrikosov vortices in superconductors. The main goal of this work is to determine the effect the addition of a three-body term has on the properties of two-dimensional clusters of classical interacting particles. In order to understand such effect, we carried out semi-analytical calculations and numerical minimization of the system free energy, using a simulated annealing scheme based on the Langevin dynamics. We considered particles (3 ≤ ≤ 50) confined in a parabolic potential and interacting via a pair potential. We considered three of the most studied pair potentials: logarithmic, Coulomb and Yukawa. The novelty in our study consisted in the addition of a short-ranged Gaussian three-body interaction potential with tunable amplitude. The obtained configurations were compared with the typical case in which the particles interact only via a pair potential. In this last situation, we recover the typical concentric rings of particles, widely found in the literature. With the addition of the three-body interaction, our findings include changes in the ring occupation numbers and the emergence of a first-order like transition associated with the bistability phenomenon due to the competition between the two- and three-body potentials. This transition is accompanied by a sudden cluster compaction, especially in the > 20 range, for all two-body potentials, and a phase separation effect starting around = 40, in which the initial single cluster was divided into smaller ones. These results indicate that the three-body term in the interaction potential of many confined particles can induce dramatic changes in the equilibrium configurations and, therefore, should not be ignored in those particle systems.
id UFPE_5aefd64eacd58505652b56b06fdee18d
oai_identifier_str oai:repositorio.ufpe.br:123456789/41391
network_acronym_str UFPE
network_name_str Repositório Institucional da UFPE
repository_id_str 2221
spelling CORREIA, Matheus Valençahttp://lattes.cnpq.br/7163730778616017http://lattes.cnpq.br/8076432608646837SILVA, Clécio Clemente de Souza2021-10-20T17:29:19Z2021-10-20T17:29:19Z2021-06-29CORREIA, Matheus Valença. Effects of three-body interactions on structural phases of classical twodimensional clusters. 2021. Dissertação (Mestrado em Física) - Universidade Federal de Pernambuco, Recife, 2021.https://repositorio.ufpe.br/handle/123456789/41391When a physical system has many interacting constituents, many-body terms will arise in the Hamiltonian, besides the usual two-body interactions. These terms are often ignored in numerical studies due to their high computational cost. However, many-body terms are responsible for important corrections in charged colloidal systems and promote structural changes in clusters of Abrikosov vortices in superconductors. The main goal of this work is to determine the effect the addition of a three-body term has on the properties of two-dimensional clusters of classical interacting particles. In order to understand such effect, we carried out semi-analytical calculations and numerical minimization of the system free energy, using a simulated annealing scheme based on the Langevin dynamics. We considered particles (3 ≤ ≤ 50) confined in a parabolic potential and interacting via a pair potential. We considered three of the most studied pair potentials: logarithmic, Coulomb and Yukawa. The novelty in our study consisted in the addition of a short-ranged Gaussian three-body interaction potential with tunable amplitude. The obtained configurations were compared with the typical case in which the particles interact only via a pair potential. In this last situation, we recover the typical concentric rings of particles, widely found in the literature. With the addition of the three-body interaction, our findings include changes in the ring occupation numbers and the emergence of a first-order like transition associated with the bistability phenomenon due to the competition between the two- and three-body potentials. This transition is accompanied by a sudden cluster compaction, especially in the > 20 range, for all two-body potentials, and a phase separation effect starting around = 40, in which the initial single cluster was divided into smaller ones. These results indicate that the three-body term in the interaction potential of many confined particles can induce dramatic changes in the equilibrium configurations and, therefore, should not be ignored in those particle systems.CNPqSistemas físicos com um grande número de componentes podem apresentar, além das interações usuais de dois corpos, contribuições de três, quatro ou mais corpos no Hamiltoniano. Frequentemente, esses termos de muitos corpos são ignorados em estudos numéricos devido ao alto custo de processamento que normalmente acarretam. No entanto, termos de muitos corpos são responsáveis por diversas correções de interesse em colóides carregados e também pela modificação estrutural de aglomerados de vórtices de Abrikosov em supercondutores. O objetivo deste trabalho é determinar o efeito do termo de três corpos nas propriedades de aglomerados bidimensionais de partículas clássicas interagentes. Para isso, realizamos estudos semi-analíticos e a minimização numérica da energia livre do sistema, utilizando um procedimento de recozimento (annealing) simulado baseado na dinâmica de Langevin. Foram consideradas partículas (3 ≤ ≤ 50) confinadas em um potencial parabólico e interagindo repulsivamente por meio de um potencial repulsivo de dois corpos. Alguns dos mais estudados potenciais de dois corpos foram considerados: logarítmico, Coulomb e Yukawa. A novidade deste trabalho consistiu em adicionar um potencial atrativo de três corpos Gaussiano de curto alcance, com intensidade variável. Os resultados foram comparados com o caso típico, quando as partículas interagem somente através do potencial de dois corpos. Nessa condição, obtivemos os típicos arranjos de partículas em anéis concêntricos, já amplamente registrados pela literatura. Com a adição da interação de três corpos, nossos achados incluíram a modificação dos números de ocupação dos anéis e o surgimento de uma transição do tipo primeira ordem associado ao fenômeno de biestabilidade devido à competição entre os potenciais de dois e três corpos. Essa transição foi acompanhada por uma abrupta compactação do sistema, especialmente para > 20, em todos os potenciais de dois corpos, e um efeito de separação de fase a partir de = 40, em que o aglomerado único foi dividido em outros menores. Esses resultados mostram que o termo de três corpos no potencial de interação de muitas partículas confinadas pode produzir mudanças dramáticas nas configurações de equilíbrio. Portanto, trata-se de contribuição que não deve ser ignorada nesses sistemas de partículas.engUniversidade Federal de PernambucoPrograma de Pos Graduacao em FisicaUFPEBrasilhttp://creativecommons.org/licenses/by-nc-nd/3.0/br/info:eu-repo/semantics/openAccessTheoretical and computational physicsThree-body interactionsClassical clustersCharged colloidsEffects of three-body interactions on structural phases of classical twodimensional clusterinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/masterThesismestradoreponame:Repositório Institucional da UFPEinstname:Universidade Federal de Pernambuco (UFPE)instacron:UFPECC-LICENSElicense_rdflicense_rdfapplication/rdf+xml; charset=utf-8811https://repositorio.ufpe.br/bitstream/123456789/41391/2/license_rdfe39d27027a6cc9cb039ad269a5db8e34MD52LICENSElicense.txtlicense.txttext/plain; charset=utf-82310https://repositorio.ufpe.br/bitstream/123456789/41391/3/license.txtbd573a5ca8288eb7272482765f819534MD53ORIGINALDISSERTAÇÃO Matheus Valença Correia.pdfDISSERTAÇÃO Matheus Valença Correia.pdfapplication/pdf10946511https://repositorio.ufpe.br/bitstream/123456789/41391/1/DISSERTA%c3%87%c3%83O%20Matheus%20Valen%c3%a7a%20Correia.pdfef416110e45a6e011f6d61e1e35b18f2MD51TEXTDISSERTAÇÃO Matheus Valença Correia.pdf.txtDISSERTAÇÃO Matheus Valença Correia.pdf.txtExtracted texttext/plain138597https://repositorio.ufpe.br/bitstream/123456789/41391/4/DISSERTA%c3%87%c3%83O%20Matheus%20Valen%c3%a7a%20Correia.pdf.txt73bd38617b5f43c7549c221f86a054d9MD54THUMBNAILDISSERTAÇÃO Matheus Valença Correia.pdf.jpgDISSERTAÇÃO Matheus Valença Correia.pdf.jpgGenerated Thumbnailimage/jpeg1211https://repositorio.ufpe.br/bitstream/123456789/41391/5/DISSERTA%c3%87%c3%83O%20Matheus%20Valen%c3%a7a%20Correia.pdf.jpgeb47dc306b99725584f56d4892c9db27MD55123456789/413912021-10-21 02:15:35.268oai:repositorio.ufpe.br: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ório InstitucionalPUBhttps://repositorio.ufpe.br/oai/requestattena@ufpe.bropendoar:22212021-10-21T05:15:35Repositório Institucional da UFPE - Universidade Federal de Pernambuco (UFPE)false
dc.title.pt_BR.fl_str_mv Effects of three-body interactions on structural phases of classical twodimensional cluster
title Effects of three-body interactions on structural phases of classical twodimensional cluster
spellingShingle Effects of three-body interactions on structural phases of classical twodimensional cluster
CORREIA, Matheus Valença
Theoretical and computational physics
Three-body interactions
Classical clusters
Charged colloids
title_short Effects of three-body interactions on structural phases of classical twodimensional cluster
title_full Effects of three-body interactions on structural phases of classical twodimensional cluster
title_fullStr Effects of three-body interactions on structural phases of classical twodimensional cluster
title_full_unstemmed Effects of three-body interactions on structural phases of classical twodimensional cluster
title_sort Effects of three-body interactions on structural phases of classical twodimensional cluster
author CORREIA, Matheus Valença
author_facet CORREIA, Matheus Valença
author_role author
dc.contributor.authorLattes.pt_BR.fl_str_mv http://lattes.cnpq.br/7163730778616017
dc.contributor.advisorLattes.pt_BR.fl_str_mv http://lattes.cnpq.br/8076432608646837
dc.contributor.author.fl_str_mv CORREIA, Matheus Valença
dc.contributor.advisor1.fl_str_mv SILVA, Clécio Clemente de Souza
contributor_str_mv SILVA, Clécio Clemente de Souza
dc.subject.por.fl_str_mv Theoretical and computational physics
Three-body interactions
Classical clusters
Charged colloids
topic Theoretical and computational physics
Three-body interactions
Classical clusters
Charged colloids
description When a physical system has many interacting constituents, many-body terms will arise in the Hamiltonian, besides the usual two-body interactions. These terms are often ignored in numerical studies due to their high computational cost. However, many-body terms are responsible for important corrections in charged colloidal systems and promote structural changes in clusters of Abrikosov vortices in superconductors. The main goal of this work is to determine the effect the addition of a three-body term has on the properties of two-dimensional clusters of classical interacting particles. In order to understand such effect, we carried out semi-analytical calculations and numerical minimization of the system free energy, using a simulated annealing scheme based on the Langevin dynamics. We considered particles (3 ≤ ≤ 50) confined in a parabolic potential and interacting via a pair potential. We considered three of the most studied pair potentials: logarithmic, Coulomb and Yukawa. The novelty in our study consisted in the addition of a short-ranged Gaussian three-body interaction potential with tunable amplitude. The obtained configurations were compared with the typical case in which the particles interact only via a pair potential. In this last situation, we recover the typical concentric rings of particles, widely found in the literature. With the addition of the three-body interaction, our findings include changes in the ring occupation numbers and the emergence of a first-order like transition associated with the bistability phenomenon due to the competition between the two- and three-body potentials. This transition is accompanied by a sudden cluster compaction, especially in the > 20 range, for all two-body potentials, and a phase separation effect starting around = 40, in which the initial single cluster was divided into smaller ones. These results indicate that the three-body term in the interaction potential of many confined particles can induce dramatic changes in the equilibrium configurations and, therefore, should not be ignored in those particle systems.
publishDate 2021
dc.date.accessioned.fl_str_mv 2021-10-20T17:29:19Z
dc.date.available.fl_str_mv 2021-10-20T17:29:19Z
dc.date.issued.fl_str_mv 2021-06-29
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/masterThesis
format masterThesis
status_str publishedVersion
dc.identifier.citation.fl_str_mv CORREIA, Matheus Valença. Effects of three-body interactions on structural phases of classical twodimensional clusters. 2021. Dissertação (Mestrado em Física) - Universidade Federal de Pernambuco, Recife, 2021.
dc.identifier.uri.fl_str_mv https://repositorio.ufpe.br/handle/123456789/41391
identifier_str_mv CORREIA, Matheus Valença. Effects of three-body interactions on structural phases of classical twodimensional clusters. 2021. Dissertação (Mestrado em Física) - Universidade Federal de Pernambuco, Recife, 2021.
url https://repositorio.ufpe.br/handle/123456789/41391
dc.language.iso.fl_str_mv eng
language eng
dc.rights.driver.fl_str_mv http://creativecommons.org/licenses/by-nc-nd/3.0/br/
info:eu-repo/semantics/openAccess
rights_invalid_str_mv http://creativecommons.org/licenses/by-nc-nd/3.0/br/
eu_rights_str_mv openAccess
dc.publisher.none.fl_str_mv Universidade Federal de Pernambuco
dc.publisher.program.fl_str_mv Programa de Pos Graduacao em Fisica
dc.publisher.initials.fl_str_mv UFPE
dc.publisher.country.fl_str_mv Brasil
publisher.none.fl_str_mv Universidade Federal de Pernambuco
dc.source.none.fl_str_mv reponame:Repositório Institucional da UFPE
instname:Universidade Federal de Pernambuco (UFPE)
instacron:UFPE
instname_str Universidade Federal de Pernambuco (UFPE)
instacron_str UFPE
institution UFPE
reponame_str Repositório Institucional da UFPE
collection Repositório Institucional da UFPE
bitstream.url.fl_str_mv https://repositorio.ufpe.br/bitstream/123456789/41391/2/license_rdf
https://repositorio.ufpe.br/bitstream/123456789/41391/3/license.txt
https://repositorio.ufpe.br/bitstream/123456789/41391/1/DISSERTA%c3%87%c3%83O%20Matheus%20Valen%c3%a7a%20Correia.pdf
https://repositorio.ufpe.br/bitstream/123456789/41391/4/DISSERTA%c3%87%c3%83O%20Matheus%20Valen%c3%a7a%20Correia.pdf.txt
https://repositorio.ufpe.br/bitstream/123456789/41391/5/DISSERTA%c3%87%c3%83O%20Matheus%20Valen%c3%a7a%20Correia.pdf.jpg
bitstream.checksum.fl_str_mv e39d27027a6cc9cb039ad269a5db8e34
bd573a5ca8288eb7272482765f819534
ef416110e45a6e011f6d61e1e35b18f2
73bd38617b5f43c7549c221f86a054d9
eb47dc306b99725584f56d4892c9db27
bitstream.checksumAlgorithm.fl_str_mv MD5
MD5
MD5
MD5
MD5
repository.name.fl_str_mv Repositório Institucional da UFPE - Universidade Federal de Pernambuco (UFPE)
repository.mail.fl_str_mv attena@ufpe.br
_version_ 1802310622023516160