Dear all
I need the answer for the following question
I am using the Wien2k code to calculate the imaginary part of the complex
dielectric function has certain limitations: the local field effects are
neglected, phonon contributions to the optical spectra band gap and
excitonic effects are not
Dear Sikander Azam,
there seems to be agreement that DFT calculates the ground state, and
that this state is occupied at T=0 K. So there are two cases:
1) If comparison with your experiment works at some finite temperature
it stands to reason that the probability of observing the ground
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