Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 109, Issue 17, Pages 3957-3959Publisher
AMER CHEMICAL SOC
DOI: 10.1021/jp0404596
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The derivation of the Hirshfeld atoms in molecules from information theory is clarified. The importance for chemistry of the concept of atoms in molecules (AIM) is stressed, and it is argued that this concept, while highly useful, constitutes a noumenon in the sense of Kant.
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