3.226880 17.926880 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) 2 # number of correlated atoms 1 1 2 # iatom, nL, locrot 2 2 1 # L, qsplit, cix -0.0469030 0.0650620 -0.0878840 # new z-axis 0.0009370 -0.0986650 0.0003380 # new x-axis 2 1 2 # iatom, nL, locrot 2 2 2 # L, qsplit, cix 0.0469020 -0.0650640 0.0878840 # new z-axis -0.0009340 0.0986630 -0.0003380 # new x-axis #================ # Siginds and crystal-field transformations for correlated orbitals ================ 2 5 5 # Number of independent kcix blocks, max dimension, max num-independent-components 1 5 5 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- 'z^2' 'x^2-y^2' 'xz' 'yz' 'xy' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 2 0 0 0 0 0 3 0 0 0 0 0 4 0 0 0 0 0 5 #---------------- # Transformation matrix follows ----------- 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 0.00000000 0.00000000 0.5 0.5 0.00000000 0.00000000 -0.5 0.5 0.00000000 0.00000000 0.00000000 0.00000000 0.5 -0.5 0.00000000 0.00000000 -0.5 -0.5 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 5 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- 'z^2' 'x^2-y^2' 'xz' 'yz' 'xy' #---------------- # Sigind follows -------------------------- 6 0 0 0 0 0 7 0 0 0 0 0 8 0 0 0 0 0 9 0 0 0 0 0 10 #---------------- # Transformation matrix follows ----------- 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 0.00000000 0.00000000 0.5 0.5 0.00000000 0.00000000 -0.5 0.5 0.00000000 0.00000000 0.00000000 0.00000000 0.5 -0.5 0.00000000 0.00000000 -0.5 -0.5 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000