NWPW Optimization Fail to Converge for a Tutorial Job

You are viewing a single post from the thread title above

Click here for full thread

Clicked A Few Times

Threads 18
Posts 34

7:05:11 PM PDT - Sun, May 8th 2011
I just confirm that this unconverged result only happens when more than 1 cpu is required. I got the converged result in the 6th optimization cycle as expect when only 1 cpu was required. Does any one able to reproduce this error in NWChem ver. 6.0?

Who's here now Members 0 Guests 0 Bots/Crawler 0

AWC's: 2.5.10 MediaWiki - Stand Alone Forum Extension
Forum theme style by: AWC