Article ID Journal Published Year Pages File Type
1634221 Procedia Materials Science 2014 6 Pages PDF
Abstract

We present how the Empirical Potential Structure Refinement (EPSR) technique developed by A. Soper and co-workers can be applied to borosilicate glasses of nuclear interest to build realistic atomistic models. In particular, we show how the atomistic configuration for a six-oxide glass is modified by the introduction of the empirical potential during the simulation. EPSR strengths and weaknesses are then brought out by comparing simulation results with experimental data.

Related Topics
Physical Sciences and Engineering Materials Science Metals and Alloys