ONIOM
- From: rubenmp^at^correo.uniovi.es
- Subject: ONIOM
- Date: Sat, 14 May 2005 13:50:43 +0200
Dear CCLers,
I'm carring out ONIOM calculations.I don't know what is the way
to assign diferent basis functions for diferent atoms in the same
layer (for example pseudopotentials for halogens and other basis
functions for rest).
Thanks in advance.
R.
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