Dear Molpro users,<br><br>I encounted a confused problem when doing the multi calcultion.<br>Using the same input including basis, initial orbital and multi input specification, it can get converged results sometime, but often occured a non-zero pspace error depending the time and platform. For example, I got well converged results on a AMD opteraon + redhat9 platform, but occured non-zero pspace error when run at a Itanium2 + redhat platform using complete same input. It's real confused and disappointed problem when need transfer a big job from small platform to a big platform. Does anyone else have this problem?
<br><br>Best regards,<br><br>Wang Bingwu<br>Chemistry Department, Peking University<br>Tel: 86-10-62765703<br>email: <a href="mailto:firstname.lastname@example.org">email@example.com</a><br>