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Variational Calculations of the 2S3 State of Helium

J. Traub, Henry M. Foley

Open publisher page 11 citations

Abstract

With a 12-parameter Hylleraas-type wave function containing only positive powers, a new calculation has been carried out for the $2^{3}S$ state of helium by the Ritz variational principle. The energy was minimized by a descent process. A nonrelativistic energy of -1.0876088 Hylleraas units was reached as compared with the best previously published value of -1.0876015 Hylleraas units from a 6-parameter function. When masspolarization and ${\ensuremath{\alpha}}^{2}{R}_{y}$ corrections are included, the 12-parameter function gives an ionization potential 2.52 ${\mathrm{cm}}^{\ensuremath{-}1}$ less than the experimental value of 38 454.64 ${\mathrm{cm}}^{\ensuremath{-}1}$. The electron density at the nucleus is also calculated and compared with the experimental hyperfine-spectrum value. All numerical work was carried out on an I.B.M. 650 computer.

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What this paper is about

With a 12-parameter Hylleraas-type wave function containing only positive powers, a new calculation has been carried out for the $2^{3}S$ state of helium by the Ritz variational principle. The energy was minimized by a descent process. A nonrelativistic energy of -1.0876088 Hylleraas units was reached as compared with the best previously published value of -1.0876015 Hylleraas units from a 6-parameter function. When masspolarization and ${\ensuremath{\alpha}}^{2}{R}_{y}$ corrections are included, the 12-parameter function gives an ionization potential 2.52 ${\mathrm{cm}}^{\ensuremath{-}1}$ less than the experimental value of 38 454.64 ${\mathrm{cm}}^{\ensuremath{-}1}$. The electron density at the nucleus is also calculated and compared with the experimental hyperfine-spectrum value. All numerical work was carried out on an I.B.M. 650 computer.

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Available abstract

With a 12-parameter Hylleraas-type wave function containing only positive powers, a new calculation has been carried out for the $2^{3}S$ state of helium by the Ritz variational principle. The energy was minimized by a descent process. A nonrelativistic energy of -1.0876088 Hylleraas units was reached as compared with the best previously published value of -1.0876015 Hylleraas units from a 6-parameter function. When masspolarization and ${\ensuremath{\alpha}}^{2}{R}_{y}$ corrections are included, the 12-parameter function gives an ionization potential 2.52 ${\mathrm{cm}}^{\ensuremath{-}1}$ less than the experimental value of 38 454.64 ${\mathrm{cm}}^{\ensuremath{-}1}$. The electron density at the nucleus is also calculated and compared with the experimental hyperfine-spectrum value. All numerical work was carried out on an I.B.M. 650 computer.

Key concepts: Physics, Energy (signal processing), Function (biology), Ionization, Ionization energy, Atomic physics, Value (mathematics), Wave function

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