[molpro-user] Iterations syntax
wangm9 at Cardiff.ac.uk
Mon Jun 11 16:13:02 BST 2007
Yes. You are right. It will be updated very soon.
Thanks for your advice.
Terry Frankcombe wrote:
> Am I correct in thinking that the online documentation for the
> ITERATIONS directive is out of date?
> Using Molpro 2006.1 patch level 85 with input like:
> ITERATIONS; DO UNCOUPLE 1 TO 4; END
> I get:
> Obsolete input ITERATIONS. Please use curley brackets:
> Yet in the docs at
> http://www.molpro.net/info/current//doc/manual/node241.html there's no
> mention of using extra braces.
School of Chemistry, Cardiff University,
Main Building, Park Place,
Cardiff CF10 3AT, UK
Telephone: +44 (0)29208 76637
E-mail: wangm9 at cardiff.ac.uk
More information about the Molpro-user