Gaussian extension: Charge is wrong way round

Bugs item #1954099, was opened at 2008-04-29 13:13
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Category: Interface
Group: None
Status: Open
Resolution: None
Priority: 5
Private: No
Submitted By: Michael Banck (mbanck)
Assigned to: Nobody/Anonymous (nobody)
Summary: Gaussian extension: Charge is wrong way round

Initial Comment:
The charge is inverted - Cation is assigned -1, and Anion +1.

I’ve attached a patch which fixes this, but maybe you want to rather invert the options in the user interface (i.e. having Dianion first), although the Gamess input deck generator has the same ordering.


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