[CP2K-user] [CP2K:14032] DFT+U KPOINTS

Krack Matthias (PSI) matthi... at psi.ch
Tue Oct 13 15:18:04 UTC 2020

Dear Bram

That’s still the case and I am not aware of somebody who is working on implementing DFT+U with k points in CP2K/QS.

Best regards


From: cp... at googlegroups.com <cp... at googlegroups.com> On Behalf Of Bram Van der Linden
Sent: Dienstag, 13. Oktober 2020 17:12
To: cp2k <cp... at googlegroups.com>
Subject: [CP2K:14032] DFT+U KPOINTS

Dear all,

In an earlier post (see https://groups.google.com/g/cp2k/c/y96rvN4xjz4/m/UmP1npeqAgAJ), it was mentioned that KPOINTS and DFT+U cannot be used at the same time. Is this issue already solved or will it be solved soon?

With kind regards,

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