Nature of Hydrogen Bond in Water
DOI:
https://doi.org/10.15407/ujpe57.2.113Keywords:
-Abstract
The work is devoted to the investigation of the physical nature of H-bonds. The H-bond potential ΦH (r, Ω ) is studied as an irreducible part of the interaction energy of water molecules. It is defined as a difference between the generalized Stillinger–David potential and the sum of dispersive and multipole interaction
potentials. The relative contribution of ΦH (r, Ω ) to the intermolecular potential does not exceed (10–15)%.
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