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# -- diffkk version 1.30 --
# program inputs or default values used:
title = diffkk: no title lines specified
xmu = ../data/fex.dat
out = t.out
isfeff = false
encol = 1
mucol = 2
iz = 26
e0 = 7112.
egrid = 1.0000 % energy grid for calculation
ewidth = 0.000 % for broadening CL data
elow = 200.0000 % how far below data range to calculate
ehigh = 500.0000 % how far above data range to calculate
end % all remaining lines will be ignored on input
-- diffkk program summary --
f''(E) was set to be
f''(E) = f''_CL(E) for E > e0+ehigh and E < e0-elow.
within the range E = [e0-elow, e0+ehigh], f'' was set to
f''(E) = f''_CL(E) + a0 + a1 * mu(E') * ( E' / e0)
+ a2 * (E' - e0) + a3 * (E' - e0)**2
where mu(E) was read from t.dat,
f''_CL(E) was found for Cu, and E' = E + e0_shift.
the values of e0_shift, a0, a1, a2, and a3 were determined to be:
e0_shift = -0.605967
a0 = 1.39921
a1 = 2.51221
a2 = -0.877579E-03
a3 = 0.125303E-05
so as to best match f''_CL(E) between E = [e0-elow, e0+ehigh]
-- end diffkk log file --
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