How to calculate the ISS (Interfacial Shear Strength) of carbon nanotubes with polymer matrix in MD simulations?

I'm trying to calculate the Interfacial Shear Strength (ISS) of carbon nanotubes with polymeric matrices with the next formula: ISS=E / PI*R*L^2 where E is the pull-out energy, R the nanotube...

12 September 2016 399 2 View