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The example allows one to get an idea of how to define projectors in case of a complex system with several atoms per unit cell.
13 lines
176 B
INI
13 lines
176 B
INI
[General]
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DOSMESH = 401
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[Shell 1]
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EWINDOW = -8.6 2.7
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#EWINDOW = -0.6 2.7
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LSHELL = 2
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IONS = 5..8
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NORMION = True
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TRANSFILE = rotations
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#TRANSFILE = rot_dz2_dx2
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NORMALIZE = True
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