0.917430 18.417430 1 2 # hybridization Emin and Emax, measured from FS, renormalize for interstitials, projection type 1 0.025 0.025 600 -3.000000 1.000000 # matsubara, broadening-corr, broadening-noncorr, nomega, omega_min, omega_max (in eV) 4 # number of correlated atoms 1 1 -1 # iatom, nL, locrot 2 2 1 # L, qsplit, cix -0.79186998 -0.14777355 -0.59254106 -0.60992164 0.14272575 0.77950302 -0.03061906 0.97866866 -0.20315052 2 1 -1 # iatom, nL, locrot 2 2 2 # L, qsplit, cix -0.79186998 -0.14777355 -0.59254106 -0.60992164 0.14272575 0.77950302 -0.03061906 0.97866866 -0.20315052 3 1 -1 # iatom, nL, locrot 2 2 3 # L, qsplit, cix -0.79186998 -0.14777355 -0.59254106 -0.60992164 0.14272575 0.77950302 -0.03061906 0.97866866 -0.20315052 4 1 -1 # iatom, nL, locrot 2 2 4 # L, qsplit, cix -0.79186998 -0.14777355 -0.59254106 -0.60992164 0.14272575 0.77950302 -0.03061906 0.97866866 -0.20315052 #================ # Siginds and crystal-field transformations for correlated orbitals ================ 4 5 2 # Number of independent kcix blocks, max dimension, max num-independent-components 1 5 2 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- 'xz' 'yz' 'xy' 'z^2' 'x^2-y^2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- 0.25777674 0.19321738 0.62945866 -0.00000000 -0.00000000 -0.00000000 0.17659408 0.60417939 -0.25777674 -0.19321738 0.55082145 -0.00000000 -0.02031046 0.44292576 -0.00000000 0.00000000 -0.02031046 -0.44292576 -0.55082145 0.00000000 -0.23674924 0.19173873 0.63811133 0.00000000 -0.00000000 0.00000000 0.13259762 -0.62418262 0.23674924 -0.19173873 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 2 5 2 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- 'xz' 'yz' 'xy' 'z^2' 'x^2-y^2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- 0.25777674 0.19321738 0.62945866 -0.00000000 -0.00000000 -0.00000000 0.17659408 0.60417939 -0.25777674 -0.19321738 0.55082145 -0.00000000 -0.02031046 0.44292576 -0.00000000 0.00000000 -0.02031046 -0.44292576 -0.55082145 0.00000000 -0.23674924 0.19173873 0.63811133 0.00000000 -0.00000000 0.00000000 0.13259762 -0.62418262 0.23674924 -0.19173873 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 3 5 2 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- 'xz' 'yz' 'xy' 'z^2' 'x^2-y^2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- 0.25777674 0.19321738 0.62945866 -0.00000000 -0.00000000 -0.00000000 0.17659408 0.60417939 -0.25777674 -0.19321738 0.55082145 -0.00000000 -0.02031046 0.44292576 -0.00000000 0.00000000 -0.02031046 -0.44292576 -0.55082145 0.00000000 -0.23674924 0.19173873 0.63811133 0.00000000 -0.00000000 0.00000000 0.13259762 -0.62418262 0.23674924 -0.19173873 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 4 5 2 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- 'xz' 'yz' 'xy' 'z^2' 'x^2-y^2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- 0.25777674 0.19321738 0.62945866 -0.00000000 -0.00000000 -0.00000000 0.17659408 0.60417939 -0.25777674 -0.19321738 0.55082145 -0.00000000 -0.02031046 0.44292576 -0.00000000 0.00000000 -0.02031046 -0.44292576 -0.55082145 0.00000000 -0.23674924 0.19173873 0.63811133 0.00000000 -0.00000000 0.00000000 0.13259762 -0.62418262 0.23674924 -0.19173873 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000