[CP2K-user] Phonon spectrum calculation
siqi tang
tung... at gmail.com
Wed Aug 12 10:15:45 UTC 2020
Dear CP2K developer,
I'm learning how to calculate phonon spectrum using CP2K and phonopy in
accordance with the demo (
https://www.cp2k.org/exercises:2017_uzh_cmest:phonon_calculation). The
required essentials including Phonopy package and CP2K_tools can be
installed well, but when I type the command "phonopy --cp2k -c Si.inp -d
--dim="2 2 2"", the erroneous information shown in the attached image
appears,resulting in the failure of parsing the CP2k input file by phonopy.
Please help check this issue and any useful instruction is highly
appreciated. Thanks.
Best,
Siqi
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