Theoretical Analysis of Magnetic and Electric Hyperfine Interactions on 1H and 2H Nuclei of bis(acetylacetonato) Copper (II) | Sciact - CRIS-система Института катализа

Theoretical Analysis of Magnetic and Electric Hyperfine Interactions on 1H and 2H Nuclei of bis(acetylacetonato) Copper (II) Научная публикация

Журнал

Theoretical and Experimental Chemistry
ISSN: 0040-5760 , E-ISSN: 1573-935X

Вых. Данные

Год: 1988, Том: 24, Номер: 2, Страницы: 142-147 Страниц : 6 DOI: 10.1007/BF00531186

Ключевые слова

Copper; Theoretical Analysis; Acac; Field Gradient; Hyperfine Interaction

Авторы

Plakhutin B.N. ¹ , Zhidomirov G.M. ¹

Организации

1	Institute of Catalysis, Siberian Branch of the Academy of Sciences of the USSR

The INDO method has been used in calculating the tensors of hyperfine structure and the electric field gradient on the :H and 2H nuclei in Cu(acac)2. 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.

Plakhutin B.N. , Zhidomirov G.M.
Theoretical Analysis of Magnetic and Electric Hyperfine Interactions on 1H and 2H Nuclei of bis(acetylacetonato) Copper (II)
Theoretical and Experimental Chemistry. 1988. V.24. N2. P.142-147. DOI: 10.1007/BF00531186 Scopus РИНЦ OpenAlex

Плахутин Б.Н. , Жидомиров Г.М.
Теоретический анализ магнитных и электрических сверхтонких взаимодействий на ядрах 1H и 2H бис-ацетилацетоната меди (II)
Теоретическая и экспериментальная химия. 1988. Т.24. №2. С.149-155. WOS РИНЦ CAPlusCA

Поступила в редакцию:	16 окт. 1986 г.
Опубликована в печати:	1 мар. 1988 г.

Scopus:	2-s2.0-34250096261
РИНЦ:	30854844
OpenAlex:	W2091377659

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