[CP2K-user] A error I met when I run an example provided in cp2k official website

汤羽 tangshua... at gmail.com
Fri Mar 19 08:54:08 UTC 2021


Dear cp2k users and developers,
     When I run the input file provided in "How to calculate vibrational 
spectra from AIMD <https://brehm-research.de/spectroscopy> with CP2K and 
TRAVIS <http://www.travis-analyzer.de/> (Updated 2018).", there always has 
an error. The iput and output file are list as follow. Can you give me a 
suggestion on how to solve this problem?
     Thank you in advance.
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