Hydrolysis of the amorphous silica surface. I. Structure and dynamics of the dry surface

From bulk-liquid configurations, amorphous SiO2 surfaces are generated using simulations employing a polarizable-ion model. The surfaces are analyzed based on ion environments as a function of depth into the surface. The differences in the potential models are compared.

Bibliographic Details
Main Authors: Wilson, M, Walsh, T
Format: Journal article
Language:English
Published: American Inst of Physics 2000