Density functional theory investigations on the coordination of Pa(<scp>v</scp>) with<i>N</i>,<i>N</i>-dialkylamide

Abstract

The density functional theory (DFT) method was used to study the coordination of a series of<italic>N</italic>,<italic>N</italic>-dialkylamides with Pa(<sc>v</sc>) to shed light on the inherent principles for screening amide extractants of Pa(<sc>v</sc>) from aqueous solution.

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DOI

10.1039/d0nj00687d

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