[CP2K-user] [CP2K:20428] Compatibility of EDA with other features

[Jürg Hutter]

Hi

I have to guess. ALMO has many different options and algorithms. The basic method only works with
orbitals. Therefore GAPW and GGA/MGGA functionals should work.
ALMO-EDA will most likely not work.

regards
JH

________________________________________
From: cp2k at googlegroups.com <cp2k at googlegroups.com> on behalf of Janos.Daru at googlemail.com <janos.daru at gmail.com>
Sent: Friday, July 5, 2024 11:07 AM
To: cp2k
Subject: [CP2K:20419] Compatibility of EDA with other features

Dear All,

I would like to know if ALMO EDA is compatible with metaGGA-s, or with GAPW calculations within the current implementation.

Best Regards,

Janos

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