Hi,
My environment is Ubuntu 20.04 and python 3.8.3 managed by pyenv. I
try to run the script
<https://notebook.rcc.uchicago.edu/files/acs.chemmater.9b05047/Data/bulk/dft/mu.py>,
but it will keep running and never end. When I use 'Ctrl + c' to
terminate it, it will give the following output:
$ python mu.py
[-10.999 -10.999 -10.999 ... 20. 20. 20. ] [4.973e-84
4.973e-84 4.973e-84 ... 4.973e-84 4.973e-84 4.973e-84]
I have to terminate it and obtained the following information:
^CTraceback (most recent call last):
File "mu.py", line 38, in <module>
integrand=DOS*fermi_array(energy,mu,kT)
File
"/home/werner/.pyenv/versions/datasci/lib/python3.8/site-packages/numpy/lib/function_base.py",
line 2108, in __call__
return self._vectorize_call(func=func, args=vargs)
File
"/home/werner/.pyenv/versions/datasci/lib/python3.8/site-packages/numpy/lib/function_base.py",
line 2192, in _vectorize_call
outputs = ufunc(*inputs)
File "mu.py", line 8, in fermi
return 1./(exp((E-mu)/kT)+1)
KeyboardInterrupt
Any helps and hints for this problem will be highly appreciated?
Regards,
--
Hongyi Zhao <hongyi.z...@gmail.com>
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