ABINIT Discussion Forums

Hello abinit users!

I am planning to calculate the decomposed energies (E_Kin, E_XC,.. etc) from a manually generated charge density, in other words, using NSCF calculation.

However, it seems like if I run an NSCF calculation, the code does not print the energy.

Should I change the code to make an energy output? If so, where should I modify the code?
Or could there be a better way of doing it?

Any comments would be most appreciated.

Thank you very much.

If you do an SCF calculation with nstep 1, nline 0, the output will be just the result of the input density.