Related Experiment Video
Updated: Sep 29, 2026

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
Published on: April 8, 2020
Water polarizability in condensed phase: ab initio evaluation by cluster approach
1Department of Chemistry, Graduate School of Science, Kyoto University, Kyoto 606-8502, Japan. morita@kuchem.kyoto-u.ac.jp
Abstract:
The polarizability of a water molecule in liquid is evaluated via ab initio and density functional calculations for water clusters. This work has considerably improved our previous effort [J Chem Phys 1999, 110, 11987] to attain quantitative accuracy for polarizability. The calculations revealed that the water polarizability in the liquid is reduced from that in the gaseous phase by 7-9%. These results suggest significant implications for polarizable water models.
Related Concept Videos
Bond Polarity, Dipole Moment, and Percent Ionic Character
Molecular Geometry and Dipole Moments
Molecular Shape and Polarity
Potential Due to a Polarized Object
Comparing Intermolecular Forces: Melting Point, Boiling Point, and Miscibility
Temporary attractive forces like dispersion are present in all molecules, whether they are polar or nonpolar. They...
Polar Covalent Bonds

