From owner-chemistry-!at!-ccl.net Mon Oct 10 11:42:00 2016
From: "Xing Yin xiy726(-)gmail.com" <owner-chemistry{}server.ccl.net>
To: CCL
Subject: CCL:G: High-precision NBO Fock matrix output?
Message-Id: <-52394-161010114034-26022-Bx7LHZKrYplRh97PuYnusA{}server.ccl.net>
X-Original-From: Xing Yin <xiy726/a\gmail.com>
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Date: Mon, 10 Oct 2016 11:40:28 -0400
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Sent to CCL by: Xing Yin [xiy726{:}gmail.com]
Dear All,

I'm using the built-in NBO in Gaussian 09 to do some analysis. The printed Fock matrix in natural orbital basis has only 4 decimal digits and the smallest non-zero matrix element is already 0.0001 
Hatree (~21.9 cm-1), which is too large in some cases. Is there any way to get high precision natural orbital Fock matrixes in the built-in NBO 3.1? I do not have access to newer NBO versions.

Thanks and best wishes,
Xing