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January 19, 2007Journal of Computational ChemistryOpen Access

Improved grid‐based algorithm for Bader charge allocation

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Authors

ESEdward SanvilleLos Alamos National LaboratorySKS.D. KennyLoughborough UniversityRSRoger SmithLoughborough University

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Sanville et al. (2007) studied this question.

synapsesocial.com/papers/69d417c84172c233df86fc0bhttps://doi.org/10.1002/jcc.20575
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