[Jmol-developers] [ jmol-Bugs-3375623 ] regression from version 11 in displaying NWChem results

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Bugs item #3375623, was opened at 2011-07-22 10:01
Message generated for change (Settings changed) made by hansonr
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Category: Application
Group: v12
Status: Open
>Resolution: Fixed
Priority: 5
Private: No
Submitted By: Giacomo Mulas (gmulas)
Assigned to: Bob Hanson (hansonr)
Summary: regression from version 11 in displaying NWChem results

Initial Comment:
If I load the output of a vibrational analysis by NWChem (v6.0 even if I don't think version is relevant) with the latest released jmol, vibrational modes are rendered properly, but IR intensity is not shown among properties in the AtomSetChooser. It is properly displayed in versions 11.8.18, 11.2.1 and probably earlier ones. I attach one such output (gzipped) to reproduce the problem.

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>Comment By: Bob Hanson (hansonr)
Date: 2011-07-22 11:24

Message:
12.0 should work, just not 12.1. I've fixed that but need to fix a few
other things before uploading.

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You can respond by visiting: 
https://sourceforge.net/tracker/?func=detail&atid=379133&aid=3375623&group_id=23629