[CP2K-user] dft_plu_U Lowdin for geo_opt

pavan kumar behara pavan... at gmail.com
Fri Feb 21 20:05:03 UTC 2020

Hello CP2K developers/users,

This might be a naive question, since the forces are not implemented for
Lowdin method of dft_plus_U is it still okay to use for geometry
optimization? I know it is a no-go for molecular dynamics.

Best regards,
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