From owner-nwchem-users@emsl.pnl.gov Wed Nov 12 12:05:26 2008 Received: from odyssey.emsl.pnl.gov (localhost.pnl.gov [127.0.0.1]) by odyssey.emsl.pnl.gov (8.14.1/8.14.1) with ESMTP id mACK5OIk017149 for ; Wed, 12 Nov 2008 12:05:25 -0800 (PST) Received: (from majordom@localhost) by odyssey.emsl.pnl.gov (8.14.1/8.14.1/Submit) id mACK5Oef017148 for nwchem-users-outgoing-0915; Wed, 12 Nov 2008 12:05:24 -0800 (PST) X-Authentication-Warning: odyssey.emsl.pnl.gov: majordom set sender to owner-nwchem-users@emsl.pnl.gov using -f X-Ironport-SG: OK_Domains X-Ironport-SBRS: 3.8 X-IronPort-Anti-Spam-Filtered: true X-IronPort-Anti-Spam-Result: AqEBADPGGklKfSweimdsb2JhbACTdz4BAQEKCQwHDwWvMYEDi3sBAwEDg1Q X-IronPort-AV: E=Sophos;i="4.33,592,1220252400"; d="scan'208";a="60129352" DKIM-Signature: v=1; a=rsa-sha256; c=relaxed/relaxed; d=gmail.com; s=gamma; h=domainkey-signature:received:received:message-id:date:from:to :subject:cc:in-reply-to:mime-version:content-type :content-transfer-encoding:content-disposition:references; bh=GIP61mGbuVMxi2NWgTo+s/9jumCWXhUQzUCYRdrl3cU=; b=QT2bje3PIOP1L1E9LwhQ+dcf95q9/WgSBXF3Nsdb8Cz+Y+cwITlmGtO6YlHwJtBVnh JzOw9HGvoScGcQLVOQS6YUlyLzjN70cE3E14ggahiSI53aT97MNcmkt+ynAjjyCmTqMM 6PjIFJZV7H9E4tSvbXYMLTe5wTrkMsY1R2z9I= DomainKey-Signature: a=rsa-sha1; c=nofws; d=gmail.com; s=gamma; h=message-id:date:from:to:subject:cc:in-reply-to:mime-version :content-type:content-transfer-encoding:content-disposition :references; b=fTqVbbAysHy252b1v4H3gMxDr45P4t/8qlMYCHIBWOY8yH8x/fRP8moiI4nvMvsDzH mT8vwJkTPtJ/wMGC5yES/yeG8oAxwGBnD74bYBFfTQTg2P9I5StaW65w9xWeu3kBzhN3 vli7kLx28BFiLJ1NbqC7FeEhACGa8w0kn3zCI= Message-ID: <96f4bb620811121204u217f3395ne6e820f4e3906c82@mail.gmail.com> Date: Wed, 12 Nov 2008 14:04:46 -0600 From: "Jeff Hammond" To: "Nilson Tavares Filho" Subject: Re: [NWCHEM] tce too many open files Cc: nwchem-users@emsl.pnl.gov In-Reply-To: <491B2DC9.60500@gmail.com> MIME-Version: 1.0 Content-Type: text/plain; charset=ISO-8859-1 Content-Transfer-Encoding: 7bit Content-Disposition: inline References: <49186778.6010402@gmail.com> <96f4bb620811100927h344017bek4394f6218b536116@mail.gmail.com> <491B2DC9.60500@gmail.com> Sender: owner-nwchem-users@emsl.pnl.gov Precedence: bulk No, you cannot change the number of EAF files created if you use the ga_eaf IO scheme. You might try "io dra" or "io sf" though. The amelioration of the file issues when running as root suggests a problem not related to NWChem but rather your system configuration. Try to figure out what the relevant issue is for your operating system. Jeff On Wed, Nov 12, 2008 at 1:26 PM, Nilson Tavares Filho wrote: > Hi again! > > I have tried Jeff's and Karol's suggestions (thanks for the help!): > recompiled nwchem with "EAF_MAX_FILES 16384" > and increased stack memory, but the error was the same. > I ran the calculation with root privileges and ... the problem was gone. > > Since I have tried to rise the max number of open files on the system for > the > normal user without success, I would like to ask again if is there a way to > reduce > the amount of scratch files created by tce module? Some keyword in the tce > block > of input file? > > Any help will be appreciated. > > Thanks a lot. > > Nilson. > > > -- Jeff Hammond The University of Chicago http://home.uchicago.edu/~jhammond/