[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 
proceed.

Best,
Phillips

-- 
You received this message because you are subscribed to the Google Groups "cp2k" group.
To unsubscribe from this group and stop receiving emails from it, send an email to cp2k+unsubscribe at googlegroups.com.
To view this discussion on the web visit https://groups.google.com/d/msgid/cp2k/cdc044c0-ccf3-43d0-bb12-864c8592bdfbn%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20230719/28560cdb/attachment-0001.htm>


More information about the CP2K-user mailing list