how to get frequency dependent dilectric constant
Posted: Wed Aug 04, 2010 11:12 pm
Hi,
I am trying to calculate frequency dependent dielectric constant. I first ran for SCF calculation and then ran for non SCF calculation using ICHAG = 11 and ISTART = 2. Then I generated OPTIC file using LOPTICS = REAL and NPAR = 1. I also have codes "Optics.f" of prof. Furthmuller. Now how can I get OPTCTR file? and also do I need OPTCTR file ?
Thank you for help.
hpaudel
I am trying to calculate frequency dependent dielectric constant. I first ran for SCF calculation and then ran for non SCF calculation using ICHAG = 11 and ISTART = 2. Then I generated OPTIC file using LOPTICS = REAL and NPAR = 1. I also have codes "Optics.f" of prof. Furthmuller. Now how can I get OPTCTR file? and also do I need OPTCTR file ?
Thank you for help.
hpaudel