[CP2K-user] Subsection FORCES of section PRINT

siqi tang tung... at gmail.com
Wed Aug 12 10:01:52 UTC 2020

Dear Viktoria,

Sorry to disturb you.

I'm also learning the Phonospectrum calculation using Phonopy with CP2K, in 
accordance with the case you mentioned. The essentials have been installed 
well, including Phonopy setup and the cp2k-tools. But when I typed the 
command "phonopy  --cp2k -c Si.inp -d -dim=="2 2 2", the Phonopy failed to 
parse the cp2k input file, the erroneous information "ImportError: No 
module named 'cp2k_input_tools‘” as shown below.

[image: 捕获.PNG]

Any useful suggestions are welcome and appreciated.

Thanks and Best Regards,


在2018年6月6日星期三 UTC+8 下午4:15:37<s... at gmail.com> 写道:

> Hello everyone,
> I am using cp2k 5.2.1 installed and compiled through homebrew. I am trying 
> to use it with phonopy to get phonon spectra according to this tutorial (
> https://www.cp2k.org/exercises:2017_uzh_cmest:phonon_calculation), but 
> get an error message about unknown subsection. I get that the feature was 
> implemented in cp2k 6.0? Is cp2k 6.0 available?
> Best,
> Viktoria
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