Modified B function basis sets with generalized hyperbolic cosine functions

[Display omitted] •Efficiency of the hyperbolic cosine type B functions (BTOs-GHC) has been investigated.•The results are compared with the results of other exponential type orbitals.•The total and orbital energy values are significantly close to numerical results.•One of the most efficient basis fu...

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Bibliographic Details

Published in:	Computational and theoretical chemistry Vol. 1127; pp. 37 - 43
Main Authors:	Erturk, M., Ozturk, E.
Format:	Journal Article
Language:	English
Published:	Elsevier B.V 01.03.2018
Subjects:	B functions Exponential type orbital Hartree-Fock-Roothaan method Hyperbolic cosine functions Exponential type orbital Hyperbolic cosine functions B functions Hartree-Fock-Roothaan method
ISSN:	2210-271X
Online Access:	Get full text
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