From owner-nwchem-users@emsl.pnl.gov Tue Dec 18 08:55:39 2007 Received: from odyssey.emsl.pnl.gov (localhost [127.0.0.1]) by odyssey.emsl.pnl.gov (8.14.1/8.14.1) with ESMTP id lBIGtcwd020405 for ; Tue, 18 Dec 2007 08:55:39 -0800 (PST) Received: (from majordom@localhost) by odyssey.emsl.pnl.gov (8.14.1/8.14.1/Submit) id lBIGtcAd020404 for nwchem-users-outgoing-0915; Tue, 18 Dec 2007 08:55:38 -0800 (PST) X-Authentication-Warning: odyssey.emsl.pnl.gov: majordom set sender to owner-nwchem-users@emsl.pnl.gov using -f X-IronPort-AV: E=Sophos;i="4.24,180,1196668800"; d="scan'208";a="60719000" Message-ID: <4767FB87.40405@pnl.gov> Date: Tue, 18 Dec 2007 08:55:35 -0800 From: Dunyou Wang User-Agent: Thunderbird 2.0.0.9 (X11/20071031) MIME-Version: 1.0 To: =?ISO-8859-1?Q?=3F=3F=3F?= CC: nwchem-users@emsl.pnl.gov Subject: Re: [NWCHEM] how to avoid the usage of shared memory in SMP machine? References: <005701c84127$d1650e10$8364a8c0@DHJUNG@gabia@nwchem-users@emsl.pnl.gov> In-Reply-To: <005701c84127$d1650e10$8364a8c0@DHJUNG@gabia@nwchem-users@emsl.pnl.gov> Content-Type: text/plain; charset=ISO-8859-1 Content-Transfer-Encoding: 8bit X-OriginalArrivalTime: 18 Dec 2007 16:55:34.0793 (UTC) FILETIME=[CEA5C790:01C84196] Sender: owner-nwchem-users@emsl.pnl.gov Precedence: bulk Hi Dong Hyun, Try to use more processors for your calculation would solve your problem. If this still leads to that shmmax problem, then you have to ask your admin to increase the shared memory. Best Dunyou ??? wrote: > Dear users, > > I have compiled NWChem with xlf, xlc in IBM p690. > The machine has two CPUs per node and the kernel is compiled supporting SMP. > When I calculate on small systems, there is no problem. But, for large > systems, I meet the too small SHMMAX value error. I know if I change the > value to the larger value, there would be no problem. But, I am just a > user, and the administrator said he will not change the value because the > machine is for public and so the change may influence other softwares. > > I would like to use the machine. Then what would I do? > Please let me know how to do calculations without the use of shared memory > in the SMP machine. > > Thank you in advance. > ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ > Dong Hyun Jung, Ph. D > Chief Scientist > > Insilicotech Co. Ltd. > A-1101, Kolontripolis, 210, Geumgok-Dong, Seongnam, > Gyeonggi-Do, 463-805, Korea > Tel. +82-31-728-0443 Fax. +82-31-728-0444 > dhjung@insilicotech.co.kr > ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ >