"On the sensitivity of computed partial charges toward basis set and ..."

Nisha Mehta, Jan M. L. Martin (2024)

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DOI: 10.1002/JCC.27294

access: open

type: Journal Article

metadata version: 2024-06-08

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Nisha Mehta, Jan M. L. Martin:
On the sensitivity of computed partial charges toward basis set and (exchange-)correlation treatment. J. Comput. Chem. 45(13): 1017-1032 (2024)

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