From owner-chemistry@ccl.net Wed Nov  3 10:22:01 2010
From: "=?ISO-8859-1?Q?Ulf_Ekstr=F6m?= ulfek#few.vu.nl" <owner-chemistry{=}server.ccl.net>
To: CCL
Subject: CCL: BSSE calculation m06 level in NWChem
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Date: Wed, 3 Nov 2010 14:14:48 +0100
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Sent to CCL by: =?ISO-8859-1?Q?Ulf_Ekstr=F6m?= [ulfek!^!few.vu.nl]
> Can anyone tell me how to do bsse calculation in M06 level using NWCHem
> software? Kindly tell how to put an input.

Just a comment: for M06 the integration grid is quite important so you
have to look into that as well (something like "grid superposition
error"). I know this is not what you asked for, sorry if you already
knew about it.

Sincerely,
Ulf Ekstrom