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"Four-component relativistic DFT calculations of 77Se NMR ..."

Yury Yu. Rusakov, Leonid B. Krivdin (2015)

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DOI: 10.1002/JCC.23993

access: closed

type: Journal Article

metadata version: 2021-10-14

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Yury Yu. Rusakov, Leonid B. Krivdin:
Four-component relativistic DFT calculations of ⁷⁷Se NMR chemical shifts: A gateway to a reliable computational scheme for the medium-sized organoselenium molecules. J. Comput. Chem. 36(23): 1756-1762 (2015)

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