From chemistry-request@ccl.net Thu Oct 16 15:25:25 2003 Received: from cornell.edu (cornell.edu [132.236.56.6]) by server.ccl.net (8.12.8/8.12.8) with ESMTP id h9GJOrdH004527 for ; Thu, 16 Oct 2003 15:24:53 -0400 Received: from dopey (dopey.ccmr.cornell.edu [128.84.241.121]) by cornell.edu (8.9.3p2/8.9.3) with SMTP id PAA22613 for ; Thu, 16 Oct 2003 15:24:54 -0400 (EDT) Message-ID: <000d01c3941b$2d1514d0$6400000a.-at-.ccmr.cornell.edu> From: "Connie Chang" To: Subject: CCL: Help with interpretation of Gaussian error message? Date: Thu, 16 Oct 2003 15:24:53 -0400 MIME-Version: 1.0 Content-Type: multipart/alternative; boundary="----=_NextPart_000_000A_01C393F9.A5EDF100" X-Priority: 3 X-MSMail-Priority: Normal X-Mailer: Microsoft Outlook Express 6.00.2800.1158 X-MimeOLE: Produced By Microsoft MimeOLE V6.00.2800.1165 X-Spam-Status: No, hits=1.9 required=7.0 tests=FROM_ENDS_IN_NUMS,HTML_40_50,HTML_MESSAGE version=2.55 X-Spam-Level: * X-Spam-Checker-Version: SpamAssassin 2.55 (1.174.2.19-2003-05-19-exp) This is a multi-part message in MIME format. ------=_NextPart_000_000A_01C393F9.A5EDF100 Content-Type: text/plain; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable Hi -- What does this Gaussian03 error message mean? Fock matrices will be formed incrementally for 20 cycles. Integral accuracy reduced to 1.0D-05 until final iterations. Inconsistent input #3 in SPerMO. Error termination via Lnk1e in C:\g03w\l502.exe at Thu Oct 16 15:12:38 = 2003. Job cpu time: 0 days 0 hours 2 minutes 12.0 seconds. File lengths (MBytes): RWF=3D 496 Int=3D 0 D2E=3D 0 = Chk=3D 1 Scr=3D 1 I'm trying to do a force calculation on an already optimized geometry in = the presence of a field... thanks! connie ------=_NextPart_000_000A_01C393F9.A5EDF100 Content-Type: text/html; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable

Hi --

What does this Gaussian03 error message = mean?

Fock matrices will be formed = incrementally=20 for 20 cycles.
Integral accuracy reduced to 1.0D-05 until = final=20 iterations.
Inconsistent input #3 in SPerMO.
Error = termination=20 via Lnk1e in C:\g03w\l502.exe at Thu Oct 16 15:12:38 2003.
Job = cpu=20 time: 0 days 0 hours 2 minutes 12.0 = seconds.
File=20 lengths (MBytes): RWF=3D 496=20 Int=3D 0 = D2E=3D 0=20 Chk=3D 1 = Scr=3D =20 1

I'm trying to do a force calculation on = an already=20 optimized geometry in the presence of a field...

thanks!

connie

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