SR wPBE functional

From NWChem

You are viewing a single post from the thread title above
Jump to: navigation, search

Click here for full thread
Clicked A Few Times
Threads 4
Posts 6
Dear NWchem team,

I was wondering which expression NWchem uses for the enhancement factor of SR wPBE. Do you use the expression (Eq. 27) given in JCTC 2009, 5, 754?

Thank you

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