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A New Algorithm for the Calculation of Two-Center Overlap Integrals over Slater-Type Orbitals

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dc.authorscopusid22951053300
dc.authorscopusid57197128456
dc.authorscopusid15837929900
dc.authorwosidMetin, Orbay/Aag-2122-2019
dc.authorwosidMamedov (Mammadov, Mammedov), Behtiyar (Bakhtiyar)/Aac-1233-2019
dc.contributor.authorMamedov, BA
dc.contributor.authorKara, M.
dc.contributor.authorOrbay, M.
dc.contributor.authorIDOrbay, Metin/0000-0001-5405-2883
dc.date.accessioned2020-06-21T09:14:54Z
dc.date.available2020-06-21T09:14:54Z
dc.date.issued2002
dc.departmentOndokuz Mayıs Üniversitesien_US
dc.department-tempGaziosmanpasa Univ, Fac Arts & Sci, Dept Phys, Tokat, Turkey; Ondokuz Mays Univ, Fac Educ, Dept Phys, Amasya, Turkeyen_US
dc.descriptionOrbay, Metin/0000-0001-5405-2883en_US
dc.description.abstractIn this study, a new algorithm is presented for two-center overlap integrals, using translation formulas for residual and regular solid spherical harmonics in Slater-type orbitals. The compulational results obtained are in good agreement with the literature and also show a good rate of convergence and good numerical stability under a wide range of quantum numbers, orbital exponents and internuclear distances.en_US
dc.description.woscitationindexScience Citation Index Expanded
dc.identifier.endpage287en_US
dc.identifier.issn0577-9073
dc.identifier.issue3en_US
dc.identifier.scopus2-s2.0-6344222311
dc.identifier.scopusqualityQ1
dc.identifier.startpage283en_US
dc.identifier.volume40en_US
dc.identifier.wosWOS:000176171700009
dc.identifier.wosqualityQ1
dc.language.isoenen_US
dc.publisherElsevieren_US
dc.relation.ispartofChinese Journal of Physicsen_US
dc.relation.journalChinese Journal of Physicsen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.titleA New Algorithm for the Calculation of Two-Center Overlap Integrals over Slater-Type Orbitalsen_US
dc.typeArticleen_US
dspace.entity.typePublication

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