Dear EPW experts,
I have some questions associated with the free energy calculation in EPW.
What is the unit for free energy given in file YY.fe_XX? Is it Ry/Cell?
According to the Eq.(46) given in CPC 209, 116-133 (2016), the free energy difference
between the superconducting and normal states is proportional to the temperature T.
Does this mean that the energy difference will be zero at 0 K? Is it possible to calculate
the energy difference at 0 K?
Thanks for your time and response!
Best wishes,
Miao Gao
What is the unit for free energy given in file YY.fe_XX?
Moderator: stiwari
Re: What is the unit for free energy given in file YY.fe_XX?
Hi,
The units for free energy is eV.
You cannot evaluate qe (46) numerically at 0 K because the temperature also enters in Z, Z_N, and Delta through the Matsubara frequencies.
Best,
Roxana
The units for free energy is eV.
You cannot evaluate qe (46) numerically at 0 K because the temperature also enters in Z, Z_N, and Delta through the Matsubara frequencies.
Best,
Roxana
Roxana Margine
Associate Professor
Department of Physics, Applied Physics and Astronomy
Binghamton University, State University of New York
Associate Professor
Department of Physics, Applied Physics and Astronomy
Binghamton University, State University of New York