Re: [cclib-devel] ADF test files

[Adam T. <a-t...@st...>]

> I wonder if anyone can comment on the fact that for ADF we have 4
> single-point tests ('sp', 'sp_b', 'sp_c', 'sp_d'), two sp_un tests,  
> and two
> gopt tests.

Depending on whether or not ADF detects symmetry, different headers  
for the MO energies are present. Also, I think there is an additional  
keyword to tell ADF to print all the orbitals instead of a subset  
around the HOMO-LUMO gap.

Adam