dielectric constant = ********

hcy_61 · Post by **hcy_61** » Wed Jul 08, 2015 12:18 pm

Hi,

i have a big problem.

i use abinit 7.4 source packgace in windows 7 64 bit operating system and when i use GW calculation for band sturcture converging of A3(BO3)2 crystal. Dielectric constant is not calculated.

Results:

For q-point: 0.000010 0.000020 0.000030
dielectric constant = ********
dielectric constant without local fields = ********

Help pls.
TAHNKS