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Make emc.py compatible with Python3, fix KPOINTS for CASTEP

Open ganphys opened this issue 5 years ago • 1 comments

Edited the print functions to work with Python3, added from __future__ import print_function at the start to keep the Python2 compatibility, created an if case for CASTEP's KPOINTS file and removed the 0.01 weights from it.

ganphys avatar Oct 12 '20 10:10 ganphys

Coverage Status

Coverage decreased (-0.4%) to 63.613% when pulling 3e35c8632c0c7d53db46bbaa5fd28b4a31ca4fc8 on ganphys:master into 33e5214133cacff3dd06216c21e51f294cfb3538 on afonari:master.

coveralls avatar Oct 12 '20 10:10 coveralls