Transition Density from TDDFT

[oandr...@gmail.com]

Dear CP2K Group, 

I was wondering if is possible to print  the transition density like in ORCA in the TDDFT module of CP2K? 

best, 

Andres Ortega-Guerrero

[Jürg Hutter]

Hi

currently available are the printing of excitation orbitals or NTO's.
The transition density cannot be printed.

regards
JH

________________________________________
From: cp...@googlegroups.com <cp...@googlegroups.com> on behalf of oandr...@gmail.com <oandr...@gmail.com>
Sent: Monday, December 8, 2025 7:34 AM
To: cp2k
Subject: [CP2K:21995] Transition Density from TDDFT

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