Preliminary Result of Transport Properties Calculation Molten Ag-based Superionics

We studied molten Ag based superionics (AgI, Ag2S and Ag3S I) which are well defined with Vashista-Rahman potential. Molecular Dynamic simulation code is Moldy which is used for canonical ensemble (NPT). Thermal properties are obtained from Green- Kubo formalism with equilibrium molecular dynamics (EMD) simulation. These calculation results are compared with the experimentals results.