"An efficient grid-based scheme to compute QTAIM atomic properties without ..."

Juan I. Rodríguez et al. (2009)

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DOI: 10.1002/JCC.21134

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type: Journal Article

metadata version: 2020-04-01

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Juan I. Rodríguez, Andreas M. Köster, Paul W. Ayers, Ana Santos-Valle, Alberto Vela, Gabriel Merino:
An efficient grid-based scheme to compute QTAIM atomic properties without explicit calculation of zero-flux surfaces. J. Comput. Chem. 30(7): 1082-1092 (2009)

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