optimization problem of compound with symmetry C3

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optimization problem of compound with symmetry C3

From: yan qi <yanlikai_at_email.domain.hidden>
Date: Wed, 7 Jul 2004 15:37:10 +0800 (CST)

Hi, Dear friends,
How are you?
I want to optimize compound with using ADF programme,
but the programme can not run.I know the symmetry C3
can not allow, but what should I do? The compound has
104 atoms.
Best Wishes!
LK Yan

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Received on 2004-07-07 09:37:33

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