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• W2020443002 abstract "We have performed Dirac-Fock atomic structure calculations on many-electron atoms using kinetically balanced, geometric Gaussian basis sets. Our results show that “variational collapse” or bound failure does not occur even at Z=86. Furthermore, with a finite-size nuclear model, we obtain results close to the relativistic Hartree-Fock limit, with a smooth convergence from above. This opens up the possibility of optimisation of exponents in Gaussian basis set calculations within the Dirac-Fock approach for many-electron atoms." @default.
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• W2020443002 date "1989-05-01" @default.
• W2020443002 modified "2023-10-17" @default.
• W2020443002 title "Kinetically balanced geometric Gaussian basis set calculations for relativistic many-electron atoms with finite nuclear size" @default.
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• W2020443002 doi "https://doi.org/10.1016/0009-2614(89)87260-4" @default.
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