[CP2K-user] Unexpected output got

vasanth kumar vasan... at gmail.com
Thu Oct 24 05:04:45 UTC 2019


Hi

I ran geometry optimization for a molecule(file is attached). I saw a vague 
output. What is the mistake in my input? pl suggest.

Attaching input and out files
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Name: coumraniethanol.inp
Type: chemical/x-gamess-input
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Name: cou-pos-1.xyz
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