Bug#687264: [Debichem-devel] Bug#687264: aces3: MPI communication error

2013-04-22 Thread Michael Banck
tags 687264 +patch thanks On Mon, Apr 22, 2013 at 03:20:48AM +0200, Michael Banck wrote: The upside is that I've been working on a patch and I think I might be able to fix it. Patch is attached and seems to work. Michael --- ./manager/sip_server_work.F.orig 2013-04-22 00:13:01.294845683

Bug#687264: [Debichem-devel] Bug#687264: aces3: MPI communication error

2013-04-21 Thread Michael Banck
severity 687264 serious thanks On Tue, Sep 11, 2012 at 12:01:19PM +0200, Michael Banck wrote: When I run a CCSD calculation (regular HF or MP2 calculation seem fine), I get the following error and the calculation aborts when using 2 (or more) MPI processes: Error: Cannot find array