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December 12, 2019

Display of MO's using G16 Rev. B.01 Log Out | Topics | Search
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WebMO Support Forum » Bug Reports » WebMO Version 18.X » Display of MO's using G16 Rev. B.01 « Previous Next »

Author Message
Clayton Spencer
Unregistered guest
Posted on Friday, March 09, 2018 - 11:41 am:   

I'm having trouble displaying the molecular orbitals with the new revision (B.01) of Gaussian16. I run the same input file that generated displayable orbitals using G16 Rev A.03 and after upgrade to B.01 there is no option for orbital display.
JR Schmidt
Moderator
Username: Schmidt

Post Number: 606
Registered: 11-2006
Posted on Friday, March 09, 2018 - 2:17 pm:   

Clayton,

If you email me a job archive (Job Manager, select job, hit "Download"), I can easily take a look. Probably just a tiny parsing tweak needed.
Clayton Spencer
Unregistered guest
Posted on Friday, March 09, 2018 - 4:51 pm:   

Thanks. I'll do that.

Interestingly, things work fine for display of NBO's but I assume that is parsed differently.
Clayton Spencer
Unregistered guest
Posted on Sunday, March 18, 2018 - 10:57 pm:   

Any update on orbital display from G16 Rev. B.01? Thanks!

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