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- W2016932676 abstract "Abstract A program for the resolution of two-electron configurations defined on a multi-configuration | SLJM J 〉 basis is described. It is utilized for the resolution of the electronic structure of Pr 3+ in PrCl 3 . General formulas for the calculation of the electrostatic, spin-orbit and crystal field interactions are given. Results involving 4 f 2 + 4 f 5 d + 4 f 6 p interaction are compared with calculations involving 4 f 2 + 4 f 5 d or 4 f 2 + 4 f 6 p only. All things being considered, the diagonalisation of the 4 f 2 + 4 f 6 p matrix is the “cheapest” solution leading to an improved experimental/calculated energy level fit." @default.
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- W2016932676 date "1997-06-01" @default.
- W2016932676 modified "2023-09-26" @default.
- W2016932676 title "Configuration interaction in PrCl3" @default.
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- W2016932676 doi "https://doi.org/10.1016/s0038-1098(97)00064-1" @default.
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