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dc.contributor.authorBlanes, Sergio
dc.contributor.authorCasas, Fernando
dc.contributor.authorMurua, Ander
dc.date.accessioned2017-06-02T11:00:11Z
dc.date.available2017-06-02T11:00:11Z
dc.date.issued2017-03
dc.identifier.citationBLANES, Sergio; CASAS, Fernando; MURUA, Ander. Symplectic time-average propagators for the Schrödinger equation with a time-dependent Hamiltonian. The Journal of Chemical Physics, 2017, vol. 146, no 11, p. 114109.ca_CA
dc.identifier.urihttp://hdl.handle.net/10234/167790
dc.description.abstractSeveral symplectic splitting methods of orders four and six are presented for the step-by-step time numerical integration of the Schrödinger equation when the Hamiltonian is a general explicitly time-dependent real operator. They involve linear combinations of the Hamiltonian evaluated at some intermediate points. We provide the algorithm and the coefficients of the methods, as well as some numerical examples showing their superior performance with respect to other available schemes.ca_CA
dc.format.extent10 p.ca_CA
dc.format.mimetypeapplication/pdfca_CA
dc.language.isoengca_CA
dc.publisherAIP Publishingca_CA
dc.relation.isPartOfThe Journal of Chemical Physics 146, 114109 (2017)ca_CA
dc.rights© 2017 AIP Publishing LLC.ca_CA
dc.rights.urihttp://rightsstatements.org/vocab/InC/1.0/*
dc.subjectpolynomialsca_CA
dc.subjectoperator equationsca_CA
dc.subjectcomputational complexityca_CA
dc.subjectexact solutionsca_CA
dc.subjectnumerical solutionsca_CA
dc.titleSymplectic time-average propagators for the Schrodinger equation with a time-dependent Hamiltonianca_CA
dc.typeinfo:eu-repo/semantics/articleca_CA
dc.identifier.doihttp://dx.doi.org/10.1063/1.4978410
dc.rights.accessRightsinfo:eu-repo/semantics/openAccessca_CA
dc.relation.publisherVersionhttp://aip.scitation.org/doi/abs/10.1063/1.4978410ca_CA
dc.type.versioninfo:eu-repo/semantics/publishedVersion


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