Re: [cclib-devel] SCF convergence in ADF

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

> In summary, the situation is weird. Can you first try the keyword  
> Err or
> Err1 (http://www.scm.com/Doc/Doc2005.01/ADF/ADFUsersGuide/ 
> page158.html)
> to see whether it prints out anything more?
>
> Everything is understandable until GeoOpt Cycle 5, where it should  
> have
> terminated at Step 6.

The new output looks useful, although I haven't explored it as  
thoroughly as you did with the previous example. The files have been  
uploaded.

Adam