On Mar 7, 2009, at 11:31 , lan haiping wrote: > 2, About electron_velocities. For elastic scattering on ions, > should i consider the change of electron_velocities ? > I am not very clear about this tag, would you please explain > which physical process this tag account for ?
electron velocities are used in Car-Parrinello simulations and there is no related "physical process": the electron dynamics is fictitious P. --- Paolo Giannozzi, Democritos and University of Udine, Italy
