From chemistry-request _-at-_)ccl.net Fri Apr 29 10:48:47 2005 Received: from mb1i1.ns.pitt.edu (mb1i1.ns.pitt.edu [136.142.11.139]) by server.ccl.net (8.13.1/8.13.1) with ESMTP id j3TEmh8P006352 for ; Fri, 29 Apr 2005 10:48:44 -0400 Received: from [127.0.0.1] ([136.142.109.16]) by pitt.edu (PMDF V6.2-X27 #30902) with ESMTP id <01LNNWCXH58Q003W9X_at_mb1i1.ns.pitt.edu> for chemistry_at_ccl.net; Fri, 29 Apr 2005 10:48:36 -0400 (EDT) Date: Fri, 29 Apr 2005 10:48:33 -0400 From: Kadir Diri Subject: Re: CCL:NWCHEM on PSC In-reply-to: <20050428013918.78676.qmail_at_web53406.mail.yahoo.com> To: Vani Krishna Cc: chemistry Message-id: <42724941.2080309_at_visual1.chem.pitt.edu> MIME-version: 1.0 Content-type: text/plain; format=flowed; charset=us-ascii Content-transfer-encoding: 7bit X-Accept-Language: en-us, en, tr User-Agent: Mozilla/5.0 (Windows; U; Windows NT 5.1; en-US; rv:1.7.2) Gecko/20040803 References: <20050428013918.78676.qmail_at_web53406.mail.yahoo.com> X-Spam-Status: No, score=0.0 required=5.0 tests=none autolearn=failed version=3.0.1 X-Spam-Checker-Version: SpamAssassin 3.0.1 (2004-10-22) on server.ccl.net Hi! The help desk at PSC replies quickly, why don`t you send them an e-mail about the problem. Also check if you are exceeding some memory limit, when running on multiple CPUs. Obviously the problem is related to memory allocation. kadir Vani Krishna wrote: >Hi: >Iam having problems running NWchem on PSC in parallel. >I ran the example jobs on their website but only on >one processor. Anything more than one processor, my >job crashes with Malloc problems. > >Any suggestions? > >-Thanks >Vani > > > > > >__________________________________ >Do you Yahoo!? >Yahoo! Small Business - Try our new resources site! >http://smallbusiness.yahoo.com/resources/ > > >-= This is automatically added to each message by the mailing script =- >To send e-mail to subscribers of CCL put the string CCL: on your Subject: line >and send your message to: CHEMISTRY_at_ccl.net > >Send your subscription/unsubscription requests to: CHEMISTRY-REQUEST_at_ccl.net >HOME Page: http://www.ccl.net | Jobs Page: http://www.ccl.net/jobs > >If your is mail bouncing from ccl.net domain due to spam filters, please >use the Web based form from CCL Home Page >-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+-+ > > > > > >