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Computation of Molecular Integrals Over Slater-Type Orbitals. VIII. Calculation of Overlap Integrals With Different Screening Parameters Using Series Expansion Formulas for Slater-Type Orbitals

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dc.authorscopusid7006814821
dc.authorscopusid22951053300
dc.authorscopusid20434150800
dc.authorscopusid6506563771
dc.contributor.authorGuseinov, I.I.
dc.contributor.authorMamedov, B.A.
dc.contributor.authorÖner, F.
dc.contributor.authorHüseyin, S.
dc.date.accessioned2020-06-21T15:49:10Z
dc.date.available2020-06-21T15:49:10Z
dc.date.issued2001
dc.departmentOndokuz Mayıs Üniversitesien_US
dc.department-temp[Guseinov] Israfil I., Department of Physics, Çanakkale Onsekiz Mart Üniversitesi, Canakkale, Canakkale, Turkey; [Mamedov] Bahtiyar Akber, Department of Physics, Tokat Gaziosmanpaşa Üniversitesi, Tokat, Turkey; [Öner] Feda, Department of Physics, Ondokuz Mayis Üniversitesi, Samsun, Turkey; [Hüseyin] S., Department of Physics, Çanakkale Onsekiz Mart Üniversitesi, Canakkale, Canakkale, Turkeyen_US
dc.description.abstractUsing expansion formulas for the Slater-type orbitals (STOs) obtained by the one of authors [Phys. Rev. A 31 (1985) 2851] the two-center overlap integrals with different screening parameters are expressed through the overlap integrals with the same screening parameter. The series representation of overlap integrals obtained in this paper is useful for small differences of the exponential parameters. For large differences of the exponential parameters the convergence of the infinite series becomes rather slow. © 2001 Elsevier Science B.V. All rights reserved.en_US
dc.identifier.doi10.1016/S0166-1280(01)00410-9
dc.identifier.endpage270en_US
dc.identifier.issn0166-1280
dc.identifier.scopus2-s2.0-0035832729
dc.identifier.startpage265en_US
dc.identifier.urihttps://doi.org/10.1016/S0166-1280(01)00410-9
dc.identifier.urihttps://hdl.handle.net/20.500.12712/22165
dc.identifier.volume545en_US
dc.identifier.wosWOS:000170092600026
dc.language.isoenen_US
dc.publisherElsevieren_US
dc.relation.ispartofJournal of Molecular Structure: Theochemen_US
dc.relation.journalJournal of Molecular Structure-Theochemen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectOverlap Integralsen_US
dc.subjectSlater-Type Orbitalsen_US
dc.titleComputation of Molecular Integrals Over Slater-Type Orbitals. VIII. Calculation of Overlap Integrals With Different Screening Parameters Using Series Expansion Formulas for Slater-Type Orbitalsen_US
dc.typeArticleen_US
dspace.entity.typePublication

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