A new method for the solution of the Schrödinger equation

Detalhes bibliográficos
Autor(a) principal: Canosa, José
Data de Publicação: 1969
Outros Autores: Oliveira, Roberto gomes de, Instituto de Engenharia Nuclear, IBM Scientific Center
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Institucional do IEN
Texto Completo: http://carpedien.ien.gov.br:8080/handle/ien/2710
Resumo: We approximate the potential in the one-dimensional Schrödinger equation by a step function with a finite number of steps. In each step, the resulting differential equation has constant coefficients and is integrated exactly in terms of circular or hyperbolic functions. The solutions are then matched at the interface of each layer to construct the eigenfunctions in the whole domain. Unique features of the numerical method are: (a) All the eigenfunctions and eigenvalues are obtained with the same absolute accuracy for the same number of steps in the potential;(b) any desired number of eigenvalues and eigenfunctions are obtained in one single pass without any need to supply initial guesses for the eigenvalues; (c) for any fixed number of steps in the potential, we obtain in principle the whole infinite spectrum of eigenvalues and eigenfunctions.
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spelling Canosa, JoséOliveira, Roberto gomes deInstituto de Engenharia NuclearIBM Scientific Center2018-09-27T15:12:09Z2018-09-27T15:12:09Z1969-05http://carpedien.ien.gov.br:8080/handle/ien/2710Submitted by Marcele Costal de Castro (costalcastro@gmail.com) on 2018-09-27T15:12:09Z No. of bitstreams: 0Made available in DSpace on 2018-09-27T15:12:09Z (GMT). No. of bitstreams: 0 Previous issue date: 1969-05We approximate the potential in the one-dimensional Schrödinger equation by a step function with a finite number of steps. In each step, the resulting differential equation has constant coefficients and is integrated exactly in terms of circular or hyperbolic functions. The solutions are then matched at the interface of each layer to construct the eigenfunctions in the whole domain. Unique features of the numerical method are: (a) All the eigenfunctions and eigenvalues are obtained with the same absolute accuracy for the same number of steps in the potential;(b) any desired number of eigenvalues and eigenfunctions are obtained in one single pass without any need to supply initial guesses for the eigenvalues; (c) for any fixed number of steps in the potential, we obtain in principle the whole infinite spectrum of eigenvalues and eigenfunctions.engInstituto de Engenharia NuclearIENBrasilSchrodinger equationEigenfunctionsEigenvaluesMathematical solutionsA new method for the solution of the Schrödinger equationinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/article52188207info:eu-repo/semantics/embargoedAccessreponame:Repositório Institucional do IENinstname:Instituto de Engenharia Nuclearinstacron:IENLICENSElicense.txtlicense.txttext/plain; charset=utf-81748http://carpedien.ien.gov.br:8080/xmlui/bitstream/ien/2710/1/license.txt8a4605be74aa9ea9d79846c1fba20a33MD51ien/2710oai:carpedien.ien.gov.br:ien/27102018-09-27 12:12:09.085Dspace IENlsales@ien.gov.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
dc.title.pt_BR.fl_str_mv A new method for the solution of the Schrödinger equation
title A new method for the solution of the Schrödinger equation
spellingShingle A new method for the solution of the Schrödinger equation
Canosa, José
Schrodinger equation
Eigenfunctions
Eigenvalues
Mathematical solutions
title_short A new method for the solution of the Schrödinger equation
title_full A new method for the solution of the Schrödinger equation
title_fullStr A new method for the solution of the Schrödinger equation
title_full_unstemmed A new method for the solution of the Schrödinger equation
title_sort A new method for the solution of the Schrödinger equation
author Canosa, José
author_facet Canosa, José
Oliveira, Roberto gomes de
Instituto de Engenharia Nuclear
IBM Scientific Center
author_role author
author2 Oliveira, Roberto gomes de
Instituto de Engenharia Nuclear
IBM Scientific Center
author2_role author
author
author
dc.contributor.author.fl_str_mv Canosa, José
Oliveira, Roberto gomes de
Instituto de Engenharia Nuclear
IBM Scientific Center
dc.subject.por.fl_str_mv Schrodinger equation
Eigenfunctions
Eigenvalues
Mathematical solutions
topic Schrodinger equation
Eigenfunctions
Eigenvalues
Mathematical solutions
dc.description.abstract.por.fl_txt_mv We approximate the potential in the one-dimensional Schrödinger equation by a step function with a finite number of steps. In each step, the resulting differential equation has constant coefficients and is integrated exactly in terms of circular or hyperbolic functions. The solutions are then matched at the interface of each layer to construct the eigenfunctions in the whole domain. Unique features of the numerical method are: (a) All the eigenfunctions and eigenvalues are obtained with the same absolute accuracy for the same number of steps in the potential;(b) any desired number of eigenvalues and eigenfunctions are obtained in one single pass without any need to supply initial guesses for the eigenvalues; (c) for any fixed number of steps in the potential, we obtain in principle the whole infinite spectrum of eigenvalues and eigenfunctions.
description We approximate the potential in the one-dimensional Schrödinger equation by a step function with a finite number of steps. In each step, the resulting differential equation has constant coefficients and is integrated exactly in terms of circular or hyperbolic functions. The solutions are then matched at the interface of each layer to construct the eigenfunctions in the whole domain. Unique features of the numerical method are: (a) All the eigenfunctions and eigenvalues are obtained with the same absolute accuracy for the same number of steps in the potential;(b) any desired number of eigenvalues and eigenfunctions are obtained in one single pass without any need to supply initial guesses for the eigenvalues; (c) for any fixed number of steps in the potential, we obtain in principle the whole infinite spectrum of eigenvalues and eigenfunctions.
publishDate 1969
dc.date.issued.fl_str_mv 1969-05
dc.date.accessioned.fl_str_mv 2018-09-27T15:12:09Z
dc.date.available.fl_str_mv 2018-09-27T15:12:09Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
status_str publishedVersion
format article
dc.identifier.uri.fl_str_mv http://carpedien.ien.gov.br:8080/handle/ien/2710
url http://carpedien.ien.gov.br:8080/handle/ien/2710
dc.language.iso.fl_str_mv eng
language eng
dc.rights.driver.fl_str_mv info:eu-repo/semantics/embargoedAccess
eu_rights_str_mv embargoedAccess
dc.publisher.none.fl_str_mv Instituto de Engenharia Nuclear
dc.publisher.initials.fl_str_mv IEN
dc.publisher.country.fl_str_mv Brasil
publisher.none.fl_str_mv Instituto de Engenharia Nuclear
dc.source.none.fl_str_mv reponame:Repositório Institucional do IEN
instname:Instituto de Engenharia Nuclear
instacron:IEN
reponame_str Repositório Institucional do IEN
collection Repositório Institucional do IEN
instname_str Instituto de Engenharia Nuclear
instacron_str IEN
institution IEN
bitstream.url.fl_str_mv http://carpedien.ien.gov.br:8080/xmlui/bitstream/ien/2710/1/license.txt
bitstream.checksum.fl_str_mv 8a4605be74aa9ea9d79846c1fba20a33
bitstream.checksumAlgorithm.fl_str_mv MD5
repository.name.fl_str_mv Dspace IEN
repository.mail.fl_str_mv lsales@ien.gov.br
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