Vibrational ground state energy for confined molecules
Autor(a) principal: | |
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Data de Publicação: | 2019 |
Outros Autores: | |
Tipo de documento: | Artigo de conferência |
Idioma: | eng |
Título da fonte: | Repositório Institucional da UNESP |
Texto Completo: | http://dx.doi.org/10.1088/1742-6596/1194/1/012029 http://hdl.handle.net/11449/190326 |
Resumo: | The ground state vibrational energies for three confined diatomic molecules (nitrogen, lithium and NaH) are determined by using the variational method. The approach proposed allows us to build trial eigenfunctions based on wave functions obtained from the supersymmetric quantum mechanics formalism. The Morse potential is used to simulate the molecular bound and the confinement is analyzed by introducing two barriers with the minimum of the potential inside this region. The methodology adopted was successfully used previously to describe the hydrogen molecule. The conclusion from these results is that the approach can be extended for other diatomic molecules. |
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Repositório Institucional da UNESP |
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spelling |
Vibrational ground state energy for confined moleculesThe ground state vibrational energies for three confined diatomic molecules (nitrogen, lithium and NaH) are determined by using the variational method. The approach proposed allows us to build trial eigenfunctions based on wave functions obtained from the supersymmetric quantum mechanics formalism. The Morse potential is used to simulate the molecular bound and the confinement is analyzed by introducing two barriers with the minimum of the potential inside this region. The methodology adopted was successfully used previously to describe the hydrogen molecule. The conclusion from these results is that the approach can be extended for other diatomic molecules.Universidade Estadual Paulista (UNESP) Instituto de Biociencias Letras e Ciencias Exatas Campus Sao Jose Do Rio PretoUniversidade Estadual Paulista (UNESP) Instituto de Biociencias Letras e Ciencias Exatas Campus Sao Jose Do Rio PretoUniversidade Estadual Paulista (Unesp)Filho, Elso Drigo [UNESP]Silva, Josimar Fernando Da [UNESP]2019-10-06T17:09:34Z2019-10-06T17:09:34Z2019-04-24info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/conferenceObjecthttp://dx.doi.org/10.1088/1742-6596/1194/1/012029Journal of Physics: Conference Series, v. 1194, n. 1, 2019.1742-65961742-6588http://hdl.handle.net/11449/19032610.1088/1742-6596/1194/1/0120292-s2.0-8506556060632779574132915670000-0001-6536-4153Scopusreponame:Repositório Institucional da UNESPinstname:Universidade Estadual Paulista (UNESP)instacron:UNESPengJournal of Physics: Conference Seriesinfo:eu-repo/semantics/openAccess2021-10-23T19:02:02Zoai:repositorio.unesp.br:11449/190326Repositório InstitucionalPUBhttp://repositorio.unesp.br/oai/requestopendoar:29462024-08-05T18:47:59.444586Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)false |
dc.title.none.fl_str_mv |
Vibrational ground state energy for confined molecules |
title |
Vibrational ground state energy for confined molecules |
spellingShingle |
Vibrational ground state energy for confined molecules Filho, Elso Drigo [UNESP] |
title_short |
Vibrational ground state energy for confined molecules |
title_full |
Vibrational ground state energy for confined molecules |
title_fullStr |
Vibrational ground state energy for confined molecules |
title_full_unstemmed |
Vibrational ground state energy for confined molecules |
title_sort |
Vibrational ground state energy for confined molecules |
author |
Filho, Elso Drigo [UNESP] |
author_facet |
Filho, Elso Drigo [UNESP] Silva, Josimar Fernando Da [UNESP] |
author_role |
author |
author2 |
Silva, Josimar Fernando Da [UNESP] |
author2_role |
author |
dc.contributor.none.fl_str_mv |
Universidade Estadual Paulista (Unesp) |
dc.contributor.author.fl_str_mv |
Filho, Elso Drigo [UNESP] Silva, Josimar Fernando Da [UNESP] |
description |
The ground state vibrational energies for three confined diatomic molecules (nitrogen, lithium and NaH) are determined by using the variational method. The approach proposed allows us to build trial eigenfunctions based on wave functions obtained from the supersymmetric quantum mechanics formalism. The Morse potential is used to simulate the molecular bound and the confinement is analyzed by introducing two barriers with the minimum of the potential inside this region. The methodology adopted was successfully used previously to describe the hydrogen molecule. The conclusion from these results is that the approach can be extended for other diatomic molecules. |
publishDate |
2019 |
dc.date.none.fl_str_mv |
2019-10-06T17:09:34Z 2019-10-06T17:09:34Z 2019-04-24 |
dc.type.status.fl_str_mv |
info:eu-repo/semantics/publishedVersion |
dc.type.driver.fl_str_mv |
info:eu-repo/semantics/conferenceObject |
format |
conferenceObject |
status_str |
publishedVersion |
dc.identifier.uri.fl_str_mv |
http://dx.doi.org/10.1088/1742-6596/1194/1/012029 Journal of Physics: Conference Series, v. 1194, n. 1, 2019. 1742-6596 1742-6588 http://hdl.handle.net/11449/190326 10.1088/1742-6596/1194/1/012029 2-s2.0-85065560606 3277957413291567 0000-0001-6536-4153 |
url |
http://dx.doi.org/10.1088/1742-6596/1194/1/012029 http://hdl.handle.net/11449/190326 |
identifier_str_mv |
Journal of Physics: Conference Series, v. 1194, n. 1, 2019. 1742-6596 1742-6588 10.1088/1742-6596/1194/1/012029 2-s2.0-85065560606 3277957413291567 0000-0001-6536-4153 |
dc.language.iso.fl_str_mv |
eng |
language |
eng |
dc.relation.none.fl_str_mv |
Journal of Physics: Conference Series |
dc.rights.driver.fl_str_mv |
info:eu-repo/semantics/openAccess |
eu_rights_str_mv |
openAccess |
dc.source.none.fl_str_mv |
Scopus reponame:Repositório Institucional da UNESP instname:Universidade Estadual Paulista (UNESP) instacron:UNESP |
instname_str |
Universidade Estadual Paulista (UNESP) |
instacron_str |
UNESP |
institution |
UNESP |
reponame_str |
Repositório Institucional da UNESP |
collection |
Repositório Institucional da UNESP |
repository.name.fl_str_mv |
Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP) |
repository.mail.fl_str_mv |
|
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1808128981477621760 |