Indirect nuclear spin-spin coupling cons
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Preben Albertsen; Poul Jørgensen; Danny L. Yeager
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Article
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1980
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Elsevier Science
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English
⚖ 348 KB
The multiconfigurational coupled Hartree-Fock expression for the Fermi contact contnbution to the indirect nuclear spin-spin coupling constants is derived. Numerical calculations on Hz and FH indicate that the nuclear spin-spin coupling is \er)i difficult to describe in finite basis set calculations