Interaction potential of H2O molecules and water layer adsorbed on surface of aerogel nanopores
Abstract
Modeling of the water layer on the surface of airgel nanopores has been carried out. The interaction potentials between incident water molecule and water molecule adsorbed on the nanopore surface were calculated by the use B3LYP/6-31 + G (d) method. An analytical form of the isotropic potential was obtained.
- Publication:
-
24th International Symposium on Atmospheric and Ocean Optics: Atmospheric Physics
- Pub Date:
- December 2018
- DOI:
- 10.1117/12.2503791
- Bibcode:
- 2018SPIE10833E..04N