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From CCSD(T)/aug-cc-pVTZ-J to CCSD(T) complete basis set limit isotropic nuclear magnetic shieldings via affordable DFT/CBS calculations
- 1.Kupka, T., Stachów, M., Nieradka, M., Kaminský, J., Pluta, T., Sauer, S. P. A. From CCSD(T)/aug-cc-pVTZ-J to CCSD(T) complete basis set limit isotropic nuclear magnetic shieldings via affordable DFT/CBS calculations. Magnetic Resonance in Chemistry. 2011, 49(5), 231-236. ISSN 0749-1581. E-ISSN 1097-458X. Dostupné z: doi: 10.1002/mrc.2738
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