Efficient and accurate prediction of nuclear magnetic...

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Journal of Chemical Theory and Computation 2018 / 07

Efficient and accurate prediction of nuclear magnetic resonance shielding tensors with double-hybrid density functional theory

Stoychev, Georgi L, Auer, Alexander A, Neese, Frank
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Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.8b00624
Date:
July, 2018
File:
PDF, 994 KB
english, 2018
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