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This is just me or happens to everyone? Issues I have noticed:
(1) After make clean in the main folder, the tests won't work, apparently because some things are not compiled (liosolo as far as I coul…
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This error has popped up a few times in my jobs, but is not easily reproducible.
Using the cclib parser on the output file of interest it works correctly, and when I rerun the job keeping the origi…
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I have to scroll allot. Would this be an good solution? Don't know about any cons but looks pro to me.
Situation now:
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hainm updated
8 years ago
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We should add integrals for forces and multipole moments. I believe the code is already lingering in some branches but it should just be dusted a little.
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I got a weird error when trying to update the gnome-apps-nightly repo, it crashes with:
```
*** buffer overflow detected ***: /srv/gnome-sdk/root/bin/flatpak terminated
```
Backtrace details
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Time to start working on the Psi4 1.0 release notes, #hype! Please read through and update as needed @psi4/p4manage. Loosely organized at the moment, feel free to re-do.
These notes span from the Psi…
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Hi guys,
I'm trying to generate n-phenyl-1-naphthylamines liquid phase oxidation mechanism in hexane solvent, and rmg reported that "PAN" is global forbidden species, so I went back to "ForbiddenStruc…