[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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