[CP2K-user] [CP2K:22217] Forces for Reduced Excitation Space TDDFPT

[T deJ]

Dear CP2K Community,

In the latest CP2K branch, the Reduced Excitation Space (RES) method has 
been implemented for TDDFPT. This is a great method to deal with intruding 
solvent-solute CT excitations, thank you! Unfortunately, the gradients have 
not yet been implemented for TDDFPT/RES. Is this planned for a future 
release or will it remain for excitation energies only?

Best regards,
Tjeerd de Jong

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