[CP2K-user] [CP2K:21327] Re: frequencies of periodic system

[Marcella Iannuzzi]

Dear Sihem

Just remove the keyword INTENSITIES
Regards
Marcella


On Sunday, April 6, 2025 at 12:09:47 PM UTC+2 sihema... at gmail.com wrote:

> Dear all,
>
> Im triyng to calculate the frequencies of of a slab of Ru(111). The 
> Ru(111) surface consists of 3 layers (72 atoms).
> I have the following error message:
> *"Trying to access result ([DIPOLE]) which was never stored!"*
>
> *Can someone help me*
> This calculation is done after a geometry optimization.
> Sihem
>

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