Template:Stdout

N	iteration count
E	total energy
dE	change of total energy
d eps	change of the eigenvalues (fixed potential)
ncg	number of optimisation steps [math]\displaystyle{ \mathrm{H} \psi }[/math]
rms	total residual vector [math]\displaystyle{ \sum_{nk} w_{k} f_{nk} (\mathrm{H} - \epsilon_{nk}) \psi_{nk} }[/math]
rms(c)	charge density residual vector