[Wien] New Issue with SCF cycle WIEN2k19.2 (was working previously)

[Peter Blaha]

Please: Don't mess around in the Makefile, unless you know what you are 
doing.

There MUST NOT be a "complex para" option in lapw0.

Am 12.06.2020 um 08:52 schrieb Tran, Fabien:
> The message "hup: Command not found." is not important and you can ignore it.
> Concerning the error 127 during compilation, one of these (and probably others) may be helpful:
> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg12497.html
> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg04510.html
> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg06031.html
> 
> 
> From: Wien <wien-bounces at zeus.theochem.tuwien.ac.at> on behalf of Johnathon Street <jstreet1 at csub.edu>
> Sent: Thursday, June 11, 2020 11:54 PM
> To: A Mailing list for WIEN2k users
> Subject: Re: [Wien] New Issue with SCF cycle WIEN2k19.2 (was working previously)
>    
> 
> Thank you for the response. just rebuilt lapw0 and continue to get the same errors. We added a complex para to the para target and are getting make error 127 on many .o fies. Do you recommend a full recompile as the next best option?
> 
> 
> Thanks
> Johnathon Street
>   
> From: Wien <wien-bounces at zeus.theochem.tuwien.ac.at> on behalf of Tran, Fabien <fabien.tran at tuwien.ac.at>
> Sent: Thursday, June 11, 2020 1:58 PM
> To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
> Subject: Re: [Wien] New Issue with SCF cycle WIEN2k19.2 (was working previously)
>     
> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg06444.html  [mail-archive.com]​
> 
> 
> 
> 
> 
> From: Wien <wien-bounces at zeus.theochem.tuwien.ac.at> on behalf of Johnathon Street <jstreet1 at csub.edu>
> Sent: Thursday, June 11, 2020 10:45 PM
> To: A Mailing list for WIEN2k users
> Subject: [Wien] New Issue with SCF cycle WIEN2k19.2 (was working previously)
>    
> 
> Dear WIEN users,
> 
> 
> I am running WIEN2k19.2. Initially SCF cycle for WIEN2k was running with no issues. I was having an issue running Octave but have got Octave running and SCF cycle now gives message:
> hup: Command not found.
> 
> STOP  LAPW0 END​
> STOP  LAPW1 END​
> STOP  LAPW2 END​
> STOP  CORE  END​
> STOP  MIXER END​
> ec cc and fc_conv 0 1 1​
> in cycle 2    ETEST: 0   CTEST: 0​ hup: Command not found.
> 
> 
> Is this a wrong library issue? Wien2k was built with /opt/OpenBlas but we set the system libblas to the blas installed by the package manager to get octave to work.
> Any help is greatly appreciated.
> 
> 
> Thank You
> Johnathon Street
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-- 
Peter Blaha
Inst.Materials Chemistry
TU Vienna
Getreidemarkt 9
A-1060 Vienna
Austria
+43-1-5880115671