; To: A Mailing list for WIEN2k users
> Subject: Re: [Wien] Berrypi Error
>
> Caution: External email.
>
>
> Dear Sharbano,
>
> Many thanks for sharing the fix. I will take a closer look in the next couple
> of
> days.
>
> Best regards
> Oleg
>
gt; Subject: [Wien] Berrypi Error
>
> Caution: External email.
>
>
> Dear Prof. Peter Blaha and Prof. Oleg Rubel,
>
>
> hope this email finds you in good health and spirits. I am reaching out to
> respectfully report a technical challenge we recently encounter
Dear Prof. Peter Blaha and Prof. Oleg Rubel,
hope this email finds you in good health and spirits. I am reaching out to
respectfully report a technical challenge we recently encountered in our
Wien2k calculations using BerrypI, and to share the solution we found in
hopes that it might be helpful.
Dear all
I am working on the berryPI code and I have faced the following error.
Can anyone help me please?
Thank you in advance.
Traceback (most recent call last):
File "/cluster/home/lokanath/lib/w215/SRC_BerryPI/BerryPI/berrypi",
line 20, in
import numpy # math library
File
It can be related to python/numpy installation or compatibility issues.
BerryPi dependencies:
WIEN2k (tested against 14.2 Release 15/10/2014)
WIEN2WANNIER (part of the Wien2k distribution)
Python (tested against 2.7.4)
NumPy (tested against 1.6.2 & 1.9.2)
My suggestion would be to recreate the
Hello Mostefa,
I am glad the code finally worked for your installation.
I would suggest to try BiCoO3 first without the spin polarization. The spin
polarization is presently not captured in BerryPI. Could you please expand on
why do you need SP?
I never used DFT+U, so I cannot make a comment
Dear?Oleg Rubel,
I have tried the BerryPI code, but I have got this error message:
Traceback (most recent call last):
??File ~/Software/BerryPI/berrypi, line 14, in module
?? ?import calculations as b_PyCalc
??File ~/Software/BerryPI/calculations.py, line 20, in module
?? ?from collections
Dear Mostefa,
For BerryPI to work python2.6 won't work. You will need python2.7. The
reason for this is BerryPI uses some library that are only available in
python2.7.
For your assistance,Here are the BerryPI dependencies
- WIEN2k (tested against 11.1 Release 05/04/2011)
- WIEN2WANNIER
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