Units of Interpolated Dynamical matrices from ifc_fourq.F90
Posted: Fri Oct 06, 2017 6:02 pm
Hi all,
I'm trying to output dynamical matrices on a fine (interpolated) grid. I am calling the subroutine "ifc_fourq.F90" to give me these matrices. However, I'm not sure in what units they are output. I would expect Ha/bohr^2, but they don't seem to be in those units. Any help would be appreciated.
All the best,
Shane
I'm trying to output dynamical matrices on a fine (interpolated) grid. I am calling the subroutine "ifc_fourq.F90" to give me these matrices. However, I'm not sure in what units they are output. I would expect Ha/bohr^2, but they don't seem to be in those units. Any help would be appreciated.
All the best,
Shane