Dear all
I'm new to ADF and I have some trouble to do geometry optimization on a
Pt(CO)4 complex.
The program stops after listing the contributions from the various basis
sets.

The error is related to some intrapolation routine producing a long list
of what follows.

 <Dec03-2002> <16:42:43> INTRAPOLATED POINT
 <Dec03-2002> <16:42:43> too few points

I tried to increase the radialcoregrid points and also the memory, but
this does not help. In fact, I don't really know what the error is
related to and I would be very grateful if somebody could give me a
hint.

I'm using the Zora scalar relativistic approach. Basis sets are of the
TZ2P type with frozen cores for Pt up to 4f, and 1s for C and O.

Thanks in advance for your help!

katrin
Received on 2002-12-03 18:40:24