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• W2008594919 abstract "Calculations of the orbital energy vs tetrahedral (D2d and C2v) distortion parameters are reported for copper complexes on the assumption of constant metal-ligand distance. The possible ground states of the complexes are considered and the respective spin Hamiltonian parameters vs distortion parameters dependences are calculated. Comparison with experiment led to good agreement: the relation between the orbital splittings and dihedral distortion angle is found to be linear for symmetry C2v in a wide range of distortion of the regular tetrahedron, and distortion of the D2d crystal field has a compensatory effect lowering the hfs splitting from 4p-orbital admixture into the ground-state wavefunction." @default.
• W2008594919 created "2016-06-24" @default.
• W2008594919 creator A5052541228 @default.
• W2008594919 creator A5061825370 @default.
• W2008594919 date "1982-10-01" @default.
• W2008594919 modified "2023-10-16" @default.
• W2008594919 title "Crystal field theory and EPR parameters in D2d and C2v distorted tetrahedral copper(II) complexes" @default.
• W2008594919 cites W1518031381 @default.
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• W2008594919 doi "https://doi.org/10.1016/0022-4596(82)90382-6" @default.
• W2008594919 hasPublicationYear "1982" @default.
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