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Magnetic hyperfine structure constants calculated from numerical hartree‐fock wave functions
Author(s) -
Malli Gulzari
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.560010614
Subject(s) - hyperfine structure , wave function , hartree–fock method , atomic physics , basis (linear algebra) , chemistry , physics , mathematics , geometry
Magnetic hyperfine structure constants ( a a ) have been calculated for all the atoms (in the ground states) up to radon (Z = 86) using the numerical Hartree–Fock wave functions of Froese. Agreement between the experimental and calculated values of a a is extremely good, indicating that HF wave functions form an adequate basis for calculating a a .
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