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dft_tools/test/python/plovasp/converter/nio.cfg

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[General]
BASENAME = converter/nio
[Group 1]
SHELLS = 1 2
EWINDOW = -9 2
NORMION = False
NORMALIZE = True
BANDS = 2 10
[Shell 1] # Ni d shell
LSHELL = 2
IONS = 1
CORR = True
TRANSFORM = 1.0 0.0 0.0 0.0 0.0
0.0 1.0 0.0 0.0 0.0
0.0 0.0 1.0 0.0 0.0
0.0 0.0 0.0 1.0 0.0
0.0 0.0 0.0 0.0 1.0
[Shell 2] # O p shell
LSHELL = 1
IONS = 2
CORR = True
TRANSFORM = 1.0 0.0 0.0
0.0 1.0 0.0
0.0 0.0 1.0