From chemistry-request- at -server.ccl.net Wed Jul 26 08:42:02 2000 Received: from rzcomm1.rz.tu-bs.de (root- at -rzcomm1.rz.tu-bs.de [134.169.9.107]) by server.ccl.net (8.8.7/8.8.7) with ESMTP id IAA16158 for ; Wed, 26 Jul 2000 08:42:01 -0400 Received: from chemistry.upatras.gr (beuys.thc.nat.tu-bs.de [134.169.41.56]) by rzcomm1.rz.tu-bs.de (8.9.3 (PHNE_18979)/8.9.3) with ESMTP id OAA00307 for ; Wed, 26 Jul 2000 14:41:48 +0200 (METDST) Message-ID: <397EE34E.B472C3C6 #at# chemistry.upatras.gr> Date: Wed, 26 Jul 2000 16:10:38 +0300 From: Demetrios Xenides X-Mailer: Mozilla 4.7 [en] (Win98; I) X-Accept-Language: en MIME-Version: 1.0 To: chemistry%!at!%ccl.net Subject: strange (?) behaviour of G98 Content-Type: text/plain; charset=iso-8859-7 Content-Transfer-Encoding: 7bit Hi outhere, I am trying to "run" a job with the command line %nproc=4 %chk=dv_0030 %nosave #p rhf/gen scfcon=10 polar scf=direct then after ~10s the job stops and when the following appears in the end of the file Two-electron integral symmetry is turned on. 440 basis functions 632 primitive gaussians 38 alpha electrons 38 beta electrons nuclear repulsion energy 597.5471427395 Hartrees. Leave Link 301 at Wed Jul 26 12:23:13 2000, MaxMem= 16777216 cpu: 0.6 (Enter /opt/rzsoft/g98/l302.exe) One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt MDFork failed with status -1. MDFork failed. Error termination via Lnk1e in /opt/rzsoft/g98/l302.exe. Job cpu time: 0 days 0 hours 0 minutes 10.7 seconds. File lengths (MBytes): RWF= 16 Int= 0 D2E= 0 Chk= 4 Scr= 1 any suggestions? Cheers DX