Add warning if LASPH != True for meta-GGA/hybrid/vdW/+U - #2297
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Warn the user if they haven't set LASPH or set it to False for meta-GGAs/hybrids/vdW
Forgot to include hybrids
Andrew-S-Rosen
changed the title
Andrew-S-Rosen
changed the title
The default of METAGGA is None so might as well keep it that way in the .get() call
Andrew-S-Rosen
marked this pull request as draft
November 22, 2021 21:14
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Thanks @arosen93! |
This was referenced Nov 27, 2021
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This PR implements a simple
BadInputSetWarningifLASPH = False(or is not set) yet the user is running a meta-GGA/hybrid/DFT+U/vdW-DF calculation.