Imported python modules can't call nwchem functions

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 10
Posts 24
Thanks, Mernst.

I didn't know that "nwchem.py" was available as an intrinsic module.
With small (crucial) changes to the simple.py demo module, everything works.

### simple.py python module ###
import nwchem
def get_tag (tag=):
return nwchem.rtdb_get(tag)

-drh


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