LOPTICS output with vasp.5.4.4
Posted: Fri May 05, 2017 11:34 am
hi there,
I see there is two sets of dielectric function data available in the output of LOPTICS runs with vasp.5.4.4. There is the density-density response, and the current-current response both in the independent particle picture. The output from both are different by 10% from the cases I've looked at so far (liquid Al). Can someone comment on the the different treatments or point me to a reference that explains the two approaches.
thanks!
I see there is two sets of dielectric function data available in the output of LOPTICS runs with vasp.5.4.4. There is the density-density response, and the current-current response both in the independent particle picture. The output from both are different by 10% from the cases I've looked at so far (liquid Al). Can someone comment on the the different treatments or point me to a reference that explains the two approaches.
thanks!