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abinit / abipy

Open-source library for analyzing the results produced by ABINIT
http://abinit.github.io/abipy
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Boltztrap2 class and other changes #173

Closed henriquemiranda closed 6 years ago

henriquemiranda commented 6 years ago

Many changes and improvements in the Bolztrap2 driver. Added docstrings to many functions. Added option to not normalize the atomic displacement. Small changes in the function to plot the IR spectra computed from DFPT.

gmatteo commented 6 years ago

Hi,

could you fix the most important issues reported by codacity. In particular:

Issue found: Dangerous default value [] as argument Too many positional arguments for method call

Trailing whitespaces are not critical. My vim will remove them automatically when I edit the file ;)