??? wrote: > I use the dynmat.x to calculate alas.dynG
note that dynmat.f90 assumes a specific scattering geometry. You need to modify dynmat.f90 if you want the results for a different scattering geometry. > Do the column "IR" and "Raman" stand for the IR intensity and Raman > intensity? for what else should they stand for???? > And what does depol stand for? depolarization ratio -- Paolo Giannozzi, Democritos and University of Udine, Italy
