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Doublet-quartet energy separation in boron : a partitioned-correlationfunction- interaction method
- Publication Year :
- 2013
- Publisher :
- Malmö högskola, Teknik och samhälle (TS), 2013.
-
Abstract
- No lines have been observed for transitions between the doublet and quartet levels of B i. Consequently, energy levels based on observation for the latter are obtained through extrapolation of wavelengths along the isoelectronic sequence for the $2{s}^{2}2p$ ${\phantom{\rule{0.16em}{0ex}}}^{2}{P}_{3/2}^{o}$ -- $2s2{p}^{2}$ ${\phantom{\rule{0.16em}{0ex}}}^{4}{P}_{5/2}$ transition. In this paper, accurate theoretical excitation energies from a partitioned-correlation-function-interaction (PCFI) method are reported for B i that include both relativistic effects in the Breit-Pauli approximation and a finite mass correction. Results are compared with extrapolated values from observed data. For B i our estimate of the excitation energy 28 959 $\ifmmode\pm\else\textpm\fi{}$ 5 cm${}^{\ensuremath{-}1}$ is in better agreement with the values obtained by Edl\'en et al. (1969) than those reported by Kramida and Ryabtsev (2007). Our method is validated by applying the same procedure to the separation of these levels in C ii.
- Subjects :
- Physics
Extrapolation
chemistry.chemical_element
Correlation function (quantum field theory)
Atomic and Molecular Physics, and Optics
Interaction method
chemistry
Ab initio quantum chemistry methods
Naturvetenskap
Atomic physics
Relativistic quantum chemistry
Boron
Natural Sciences
Excitation
Energy (signal processing)
Subjects
Details
- Language :
- English
- Database :
- OpenAIRE
- Accession number :
- edsair.doi.dedup.....c835ec8133239ae7042ca502bea84284