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This article is cited in 4 scientific papers (total in 4 papers)
Systematic estimation of isotropic hyperfine coupling constants for protons in free radicals
N. D. Chuvylkina, A. M. Tokmachevb a N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russian Federation
b Department of Chemistry, M.V. Lomonosov Moscow State University, Moscow, Russian Federation
Abstract:
Modified formalism of consistent quantum-chemical estimations of contact interactions between magnetic moments of an unpaired electron and protons, when the spin populations of atoms are determined in the basis of symmetrically orthogonalised atomic orbitals, is presented and examined using the H2C=CHα·test free radical as an example.
Citation:
N. D. Chuvylkin, A. M. Tokmachev, “Systematic estimation of isotropic hyperfine coupling constants for protons in free radicals”, Mendeleev Commun., 9:5 (1999), 183–185
Linking options:
https://www.mathnet.ru/eng/mendc4587 https://www.mathnet.ru/eng/mendc/v9/i5/p183
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