From chemistry-request;at;ccl.net Tue Nov 11 07:01:41 2003 Received: from lgdx04.lg.ehu.es (lgdx04.lg.ehu.es [158.227.1.36]) by server.ccl.net (8.12.8/8.12.8) with ESMTP id hABC169c003141 for ; Tue, 11 Nov 2003 07:01:09 -0500 Received: by lgdx04.lg.ehu.es id NAA0000006623; Tue, 11 Nov 2003 13:01:01 +0100 (MET) Message-ID: <000a01c3a84b$7d01f640$222fe39e!at!lc.ehu.es> From: "Pablo Vitoria" To: "CCL" Subject: Gaussian03 Binary vs. Source Date: Tue, 11 Nov 2003 13:01:06 +0100 MIME-Version: 1.0 Content-Type: multipart/alternative; boundary="----=_NextPart_000_0007_01C3A853.DE84C160" 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=1.0 required=7.0 tests=HTML_30_40,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_0007_01C3A853.DE84C160 Content-Type: text/plain; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable Hi all, I am about to buy Gaussian03 to run it on Linux. I wanted to buy the = source in order to optimize it for each processor (I have both Athlon = and Xeon machines), but Gaussian only supports PGF77 compiler. I wonder = if someone out there could share sone information about: - Is it possible to use g77 or Intel ifc to compile g03? Any success? - Will the I suffer a significant performance penalty if I buy the = Athlon (PII or higher) binary to run it also on the Xeons (in order to = save money:-) ? - Any problems with Mandrake, instead of the supported Red Hat and Suse? Thank you very much Pablo -------------------------------------------------------- Pablo Vitoria Garcia Dpto. Qu=EDmica Inorg=E1nica, Facultad de Ciencias Universidad del Pa=EDs Vasco (UPV/EHU) Aptdo. 644 48080 Bilbao (Bizkaia) Tfno. 94 6015992 Fax. 94 4648500 ------=_NextPart_000_0007_01C3A853.DE84C160 Content-Type: text/html; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable

Hi all,

I am about to buy Gaussian03 to run it = on Linux. I=20 wanted to buy the source in order to optimize it for each processor (I = have both=20 Athlon and Xeon machines), but Gaussian only supports PGF77 compiler. I = wonder=20 if someone out there could share sone information about:

- Is it possible to use g77 or Intel = ifc to compile=20 g03? Any success?

- Will the I suffer a significant = performance=20 penalty if I buy the Athlon (PII or higher) binary to run it also on the = Xeons=20 (in order to save money:-) ?

- Any problems with Mandrake, instead = of the=20 supported Red Hat and Suse?

Thank you very much

Pablo

--------------------------------------------------------
Pabl= o Vitoria=20 Garcia
Dpto. Qu=EDmica Inorg=E1nica, Facultad de = Ciencias
Universidad del Pa=EDs=20 Vasco (UPV/EHU)
Aptdo. 644
48080 Bilbao (Bizkaia)

Tfno. 94 6015992
Fax. 94=20 4648500

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