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Hulthen transform functions for the 2s orbitals of atoms
Author(s) -
Gruninger John,
Bailo Richard
Publication year - 2009
Publication title -
international journal of quantum chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.484
H-Index - 105
eISSN - 1097-461X
pISSN - 0020-7608
DOI - 10.1002/qua.560060607
Subject(s) - wave function , atomic orbital , slater type orbital , atomic physics , physics , hartree–fock method , molecular orbital , quantum mechanics , linear combination of atomic orbitals , chemistry , computational chemistry , molecule , electron
Hulthén transforms of hydrogen‐like 2 s orbitals are defined and used to calculate single determinant wave functions and energies for the ground states of Li and Be. The wave functions obtained closely resemble the Hartree‐Fock wave functions.