[CP2K-user] [CP2K:22233] MOMENTS and KPOINTS
pierre.an...@gmail.com
pierre.andre.cazade at gmail.com
Tue May 12 14:47:58 UTC 2026
Dear all,
The ability to access dipole moments with KPOINTS is a major addition to
CP2K. Still, I'm confused as to where the dipole moment actually is in the
output file.
I tried the test file provided with CP2K 2026.1, but I cannot find the
dipole moment for each k-point or for the crystal.
Could you please let me know where this information is? I'm particularly
interested in the total crystal dipole moment.
Kind regards
Pierre
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