Relativistic coupled-cluster calculations of spectroscopic properties of copernicium and flerovium monoxides

Kotov, Artem A. Relativistic coupled-cluster calculations of spectroscopic properties of copernicium and flerovium monoxides / Artem A. Kotov ... [et al.]. -- Calculations of spectroscopic properties of the CnO and FlO molecules are performed using ab initio all-electron 4c- and 2c-relativistic coupled-cluster approaches with single, double, and perturbative triple excitations.

In ChemPhysChem. -- Weinheim : Wiley-VCH, 2023. -- ISSN 1439-4235. -- ISSN 1439-7641. -- Vol. 24, no. 6 (2023), pp. 1-9

1. relativistické výpočty 2. kvantovo-chemické výpočty 3. molekuly 4. DIRAC (softvér) 5. články

I. Kozhedub, Yury S.
II. Glazov, Dmitry A.
III. Iliaš, Miroslav, 1975-
IV. Pershina, Valeria
V. Shabaev, Vladimir M.
VI. ChemPhysChem. -- Vol. 24, no. 6 (2023), pp. 1-9
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