[Pw_forum] (no subject)

H.S.Domingos hsd22 at hermes.cam.ac.uk
Thu Apr 6 17:23:07 CEST 2006


I am sorry to disturb again with something that might be too obvious to 
bother you.
I have this message at the start of the second dynamics iteration run:

     from checkallsym : error #         3
      not orthogonal operation
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

can you help me with this ?

best regards,

Helder



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|  Dr. Helder S. Domingos                                             |
|                                                                     |
| INESC Microsyst & Nanotechnol, Lisbon, P-1000 Portugal              |
| and                                                                 |
| R&D unit for  Molecular Chemical Physics                            |
| Chemistry Department, University of Coimbra                         |
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