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| 6:46:58 AM PDT - Thu, Sep 1st 2011 |
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Dear NWChem users and developers,
I need to print all the orbitals of my molecule in a cube file. What do I have to do?
If I write
orbitals view; 1; 2; 3; 4; ...
it gives me an error; why?
Thank you very much
Alessandro Chiesa
IFF, Institute for advanced simulations
Forschungszentrum Juelich
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