Výsledky vyhľadávania
Názov Comparative study of electron correlation and relativistic effects in CuF, AgF, and AuF Súbež.n. Porovnávacia štúdia elektrónovo-korelačných a relativistických efektov v CuF, AgF a AuF Aut.údaje Miroslav Iliaš, Peter Furdík, Miroslav Urban Autor Iliaš Miroslav 1975- (60%) UMBFP08 - Katedra chémie
Spoluautori Furdík Peter (20%)
Urban Miroslav (20%)
Zdroj.dok. The Journal of Physical Chemistry A. Vol. 102, no. 27 (1998), pp. 5263-5268. - Washington : The American Chemical Society, 1998 Kľúč.slová electron correlation relativistic effects CuF AgF AuF Jazyk dok. angličtina Krajina Spojené štáty Systematika 54 Anotácia Spectroscopic and electric properties of the series of diatomic molecules FCu, FAg, and FAu are calculated using the coupled cluster CCSD(T) method and considering relativistic effects by the no-pair one-component Douglas−Kroll−Hess approximation. Kategória publikačnej činnosti ADC Číslo archívnej kópie 22482 Kategória ohlasu WANG, Xuefeng - ANDREWS, Lester - WILLMANN, Knut et al. Investigation of gold fluorides and nable gas complexes by matrix-isolation spectroscopy and quantum-chemical calculations. In Angewandte chemie-international edition. ISSN 1433-7851, 2012, vol. 51, no. 42, pp. 10628-10632.
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