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greenconfig.dat
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11 lines (11 loc) · 862 Bytes
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5 ! NPOL - The number of poles of the fermi function. For the DoS option there is an in-program choice.
y ! dosorno - In the case that NPOL =/= 0, there is an option to also calculate the DoS. y/n
10 ! NPNT1 - The number of points for the contour's upwards line
50 ! NPNT2 - The number of points for the contour's horizontal line
10 ! NPNT3 - The number of points for the contour's downwards line
-100.0 ! EBOT - Minimum energy. To use the lowest eigenvalue enter -100.0
v ! vecorints - Enter v to input impurity sites by vectors or i to imput impurity sites by integers.
part ! full: G(E) for all atoms, part: G(E) only for the impurity sites
y ! magorno - Enter y to prepare the magnetic chain inputs, or n to ignore.
0.0,1.0,0.0 ! ROTAXIS - The axis around which the chain's moments rotate
2,3 ! a,b - The angle rotation is given as a*PI/b