"The best density functional theory functional for the prediction of 1H and ..."

Sarah L. V. Zahn et al. (2021)

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DOI: 10.1002/JCC.26540

access: closed

type: Journal Article

metadata version: 2021-06-15

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Sarah L. V. Zahn, Ole Hammerich, Poul Erik Hansen, Stephan P. A. Sauer:
The best density functional theory functional for the prediction of 1H and 13C chemical shifts of protonated alkylpyrroles. J. Comput. Chem. 42(18): 1248-1262 (2021)

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