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- Relativistic frozen density embedding calculations of solvent effects on the nuclear magnetic resonance shielding constants of transition metal nuclei / aut. Malgorzata Olejniczak, Andrej Antušek, Michal Jaszunski
Olejniczak Malgorzata Antušek Andrej ; 067000 Jaszunski Michal
International Journal of Quantum Chemistry . Vol. 121, iss. 22 (2021), s. 1-13
frozen density embedding solvent shifts transition-metal complexes
https://onlinelibrary.wiley.com/doi/full/10.1002/qua.26789
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