State Key Laboratory of Electroanalytical Chemistry, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, 5625 Renmin Street, Changchun 130022, China. E-mail: [email protected], [email protected], [email protected]; Fax: +86 431 85262287; Tel: +86 431 85262287 Graduate University of Chinese Academy of Sciences, Beijing 100039, China State Key Laboratory of Theoretical and C...

The intermolecular forces between water molecules are of great importance in many areas of chemistry including solvation, solution chemistry, and biochemistry. As a result of this (H2O)n systems have received a great significant of attention, both experimental and theoretical. All calculation of this study are carried out by Gaussian 98 soft ware. Geometry optimization for each cluster were be ...

Theoretical chemists have been actively engaged for some time in processes such as ozone photodissociation, overtone photodissociation nitric acid, pernitric sulphuric clusters and small organic acids. The last of these shown very different behaviours the gas phase, liquid phase importantly at air–water interface aqueous aerosols. founder molecular dynamics, B J Alder, pointed out long ago that...