PC GAMESS/Firefly-related discussion club

Pasquale
morvillo@portici.enea.it

On Tue Nov 4 '08, Alex Granovsky wrote
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>Dear all,

>you CAN use DLCs for bonds, angles, and torsions scans with Firefly.
>The complete documentation will be available from our site within
>a week or so, meanwhile, I've attached a couple of samples in
>the hope they will be useful. Please post your questions on these samples directly to this forum.

>Regards,
>Alex Granovsky
>
>
>
>On Tue Nov 4 '08, Pedro Silva wrote
>-----------------------------------
>>Dear Pasquale,

>>You should not use DLC coordinates for a torsion PES scan. You should explicitly define your z-matrix, as in the example below:

>