Insight and performance of LC‐DFT vs DFT in the NMR...

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Insight and performance of LC‐DFT vs DFT in the NMR shielding and chemical shift calculations: Case of CHClCHCF3

Holtomo, Olivier, Motapon, Ousmanou, Nsangou, Mama
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Journal:
International Journal of Quantum Chemistry
DOI:
10.1002/qua.26408
Date:
August, 2020
File:
PDF, 1.94 MB
2020
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