| Autor: |
Plakhutin, B., Zhidomirov, G. |
| Zdroj: |
Theoretical & Experimental Chemistry; Mar1988, Vol. 24 Issue 2, p142-147, 6p |
| Abstrakt: |
The INDO method has been used in calculating the tensors of hyperfine structure and the electric field gradient on the H and H nuclei in Cu(acac). The procedure used in calculating the magnetic resonance parameters (MRPs) is based on an accounting for one-center and two-center 'Coulomb' integrals of dipole-dipole interaction. The influence of out-of-plane 'step' distortion of the complex on the MRPs is examined critically. [ABSTRACT FROM AUTHOR] |
| Databáze: |
Complementary Index |
| Externí odkaz: |
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