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Excited state forces as property in TDDFT#2363

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juerghutter merged 6 commits intocp2k:masterfrom
juerghutter:TDForce
Oct 19, 2022
Merged

Excited state forces as property in TDDFT#2363
juerghutter merged 6 commits intocp2k:masterfrom
juerghutter:TDForce

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The printed forces are differences to the ground state values!

@juerghutter juerghutter merged commit b050198 into cp2k:master Oct 19, 2022
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