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BSE code for core spectroscopy
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#191
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jtv3
closed
7 years ago
jtv3
commented
7 years ago
Updates to the documentation to try and say a bit more about the use of core-level shifts.
screen.pl now will call core_offset.pl for both abinit and qe
core_offset.pl has been modified to work correctly for abinit v8 and earlier (changes to cut3d)
core_offset.pl has been changed to give more informative output to the user