[Wien] help

[Gavin Abo]

Since other BoltzTraP2 users might have seen that error before, it would 
be better to ask your question below in the BoltzTraP2 Users group.  
Information on that Users group can be found on the BoltzTraP2 website [1].

That error might happen if you don't have BoltzTraP2 installed. How was 
it installed?  For example, was it installed by your system 
administrator, was it installed with pip3, and/or was it install in 
Anaconda?

Are you using the add_boltz2_to_w2web program [2]?  If so, I got the 
impression from some other users that the Facebook "Calculations of 
Solid Properties Using WIEN2K Package" group might be the best place to 
ask for support for that.  However, I'm currently not a member of that 
group.  So, I'm unable to see if they provide full or limited support 
for that there.  As mentioned on the add_boltz2_to_w2web program website 
[4], Dr. REGGAD and Dr. Benabdellah are the support contacts for that 
program.

The error might also happen if BoltzTraP2 is not setup in the Linux 
environment.  How did you setup your Linux environment and how are you 
using it?  For example, are you using a job scheduling system like PBS?  
If so, you may need to add a line of job script code to your job file 
[5].  It might be that you just need to do a system reset [6].  
Installing with pip3 (or pip depending on your Linux distribution [7]) 
should be the easy way, but if you took the install way that is likely 
harder from source code, that PATH variable may need to be setup for it 
in .bashrc [8].

[1] 
https://www.imc.tuwien.ac.at/forschungsbereich_theoretische_chemie/forschungsgruppen/prof_dr_gkh_madsen_theoretical_materials_chemistry/boltztrap2/
[2] https://groups.google.com/d/msg/boltztrap/L3F85atojBo/9U5xSONNEgAJ
[3] https://www.facebook.com/groups/wien2k.Algeria/
[4] 
http://wien2k-algerien1970.blogspot.com/2019/01/how-to-install-boltztrap2-package-and.html
[5] 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg15985.html
[6] https://groups.google.com/d/msg/boltztrap/zxrqd5UkJbs/nZE2iK3xAQAJ
[7] https://en.wikipedia.org/wiki/List_of_Linux_distributions
[8] https://groups.google.com/d/msg/boltztrap/k2gqt7gapaA/yfbRn7Y7EAAJ

On 11/9/2019 5:17 AM, Prakash Govindaraj wrote:
>
> Dear Wien,
>
>                I am Prakash g from India. During BolzTraP2 code 
> running I saw this error message. I am looking for your reply. Please 
> help me to resolve this problem.
>
> sh: line 22: btp2: command not found
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20191109/a888a1bf/attachment.html>