Dear all, when we instruct to write the LDOS, we need give two energies,( in the manual, it says the energies of the range for LDOS integration, relative to the program's zero, i.e. the same as the eigenvalues printed by the program) What does this mean? When I look up the output file, there are only 3 blocks which contain energy related information,
the first one is the in each iteration, there are some Eharris and E_KS the second one is about the program energy decomposition , and the third one is the final energy. Where are the eigenvalues? what it means " the energies of the range for LDOS integration, relative to the program's zero," thanks Lily
