[Pw_forum] How to get unfilled orbitals from ld1.x?

[Huolin Xin]

Dear all,

Is it possible to let ld1.x calculate a few more unfilled orbitals and
output them without hacking the code? Below is an input for a Si all
electron calculation.

&input
title = 'all-electron calculation for Si atom'
zed = 14.0
iswitch = 1
dft = 'LDA'
prefix = 'Si-output-neutral'
config = '[Ne] 3s2 3p2'
latt = 1
rmax = 950
dx = 0.005
/


Huolin