From chemistry-request@www.ccl.net Wed Apr 7 18:10:03 1999 Received: from cornelius.INS.CWRU.Edu (root@cornelius.INS.CWRU.Edu [129.22.8.216]) by www.ccl.net (8.8.3/8.8.6/OSC/CCL 1.0) with ESMTP id SAA09266 Wed, 7 Apr 1999 18:10:02 -0400 (EDT) Received: from raman2.cwru.edu (chem51374.CHEM.CWRU.Edu [129.22.200.174]) by cornelius.INS.CWRU.Edu with SMTP (8.8.8+cwru/CWRU-3.4) id SAA20306; Wed, 7 Apr 1999 18:10:05 -0400 (EDT) (from hxt10@po.cwru.edu for ) Message-ID: <003d01be814b$ffcce160$aec81681@cwru.edu> From: "Gavin Tsai" To: Subject: Jaguar Date: Wed, 7 Apr 1999 18:11:41 -0500 MIME-Version: 1.0 Content-Type: multipart/mixed; boundary="----=_NextPart_000_0039_01BE8122.168A8300" X-Priority: 3 X-MSMail-Priority: Normal X-Mailer: Microsoft Outlook Express 5.00.2014.211 X-MimeOLE: Produced By Microsoft MimeOLE V5.00.2014.211 This is a multi-part message in MIME format. ------=_NextPart_000_0039_01BE8122.168A8300 Content-Type: multipart/alternative; boundary="----=_NextPart_001_003A_01BE8122.168A8300" ------=_NextPart_001_003A_01BE8122.168A8300 Content-Type: text/plain; charset="big5" Content-Transfer-Encoding: quoted-printable Hi, Everyone: I just read this paper " Correlated ab initio electronic structure calculations for large molecule" JPC A V103,1913, 1999. The paper shows = the Jaguar program is about 10 times faster than G92. Can anyone share me = the performance of this program? Any comment is welcomed! Thanks! Gavin Tsai ------=_NextPart_001_003A_01BE8122.168A8300 Content-Type: text/html; charset="big5" Content-Transfer-Encoding: quoted-printable

Hi, Everyone:

I = just read=20 this paper " Correlated ab initio electronic structure
calculations = for large=20 molecule" JPC A V103,1913, 1999. The paper shows the
Jaguar = program is=20 about 10 times faster than G92. Can anyone share me the
performance = of this=20 program?

Any comment is welcomed!
Thanks!

Gavin=20 Tsai

------=_NextPart_001_003A_01BE8122.168A8300-- ------=_NextPart_000_0039_01BE8122.168A8300 Content-Type: text/x-vcard; name="Hui-Hsu (Gavin) Tsai.vcf" Content-Transfer-Encoding: quoted-printable Content-Disposition: attachment; filename="Hui-Hsu (Gavin) Tsai.vcf" BEGIN:VCARD VERSION:2.1 N:Tsai;Hui-Hsu (Gavin) FN:Hui-Hsu (Gavin) Tsai NICKNAME:Gavin ORG:CWRU, Chemistry Department TITLE:Ph.D. Candidate NOTE;ENCODING=3DQUOTED-PRINTABLE:Do molecules calculate the chemical = reaction laws before they decide=3D0D=3D0Aho=3D w to react to each others?=3D0D=3D0A TEL;HOME;VOICE:216-229-5913 ADR;HOME:;;2416 Derbyshire Road;Cleveland;OH;44106;USA LABEL;HOME;ENCODING=3DQUOTED-PRINTABLE:2416 Derbyshire = Road=3D0D=3D0ACleveland, OH 44106=3D0D=3D0AUSA X-WAB-GENDER:2 EMAIL;PREF;INTERNET:hxt10@po.cwru.edu REV:19990407T231141Z END:VCARD ------=_NextPart_000_0039_01BE8122.168A8300--