[CP2K-user] [CP2K:19130] Error in PW_DFT with SIRIUS in v2023.1

Phillips Hutchison phillips.hutchison at yale.edu
Wed Jul 19 19:13:54 UTC 2023

Dear All,

I am new to using CP2K and just compiled a copy of v2023.1. I am running 
the regtests for SIRIUS, but every test errors out with the message. The 
sample input is Au.inp in the tests/SIRIUS directory.
 unknown subsection CONTROL of section PW_DFT

I cross checked this with a public build of v2023.1 on my local cluster, 
and the same error is returned. I would appreciate any advice on how to 


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