"Modeling halogen bonding with planewave density functional theory: ..."

Shi Jun Ang, Cher Tian Ser, Ming Wah Wong (2019)

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DOI: 10.1002/JCC.25835

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type: Journal Article

metadata version: 2020-10-26

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Shi Jun Ang, Cher Tian Ser, Ming Wah Wong:
Modeling halogen bonding with planewave density functional theory: Accuracy and challenges. J. Comput. Chem. 40(20): 1829-1835 (2019)

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