Relativistic Gaussian functions for atom
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Hu, A.; Otto, P.; Ladik, J.
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Article
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1999
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John Wiley and Sons
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English
โ 333 KB
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The relativistic Gaussian basis set of Hg has been obtained by fitting the numerical relativistic atomic radial wave functions with the adaptive nonlinear least-square algorithm combined with the subset selection method. This fitting procedure and fitted results are presented. From this basis, in a