Use of lined-up auxiliary functions in the evaluation of overlap integrals over integer and non-integer n Slater type orbitals

Guseinov, Israfil IsaAndic, ZekayiMamedov, Bahtiyar A.Gorgun, Nursen Seckin2025-01-272025-01-2720192211-3797https://doi.org/10.1016/j.rinp.2018.11.047https://hdl.handle.net/20.500.12428/24760A combined theory for the overlap integrals of integer and non-integer n chi-Slater type orbitals (chi-ISTO and chi-NISTO) is presented. This approach is based on the use of lined-up auxiliary functions introduced by one of the authors. The suggested theory guarantees a highly accurate calculation of the overlap integrals for the arbitrary values of quantum numbers and locations of orbitals.eninfo:eu-repo/semantics/openAccessSlater type orbitalsOverlap integralsAuxiliary functionsUse of lined-up auxiliary functions in the evaluation of overlap integrals over integer and non-integer n Slater type orbitalsArticle1229830110.1016/j.rinp.2018.11.047Q1WOS:0004607047000382-s2.0-85057498525Q1