-1.168157 18.831843 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 0.80399554 -0.17441053 0.56848231 0.58179594 0.03313278 -0.81265965 0.12290101 0.98411543 0.12810995 2 1 -1 # iatom, nL, locrot 2 2 2 # L, qsplit, cix 0.80399554 -0.17441053 0.56848231 0.58179594 0.03313278 -0.81265965 0.12290101 0.98411543 0.12810995 3 1 -1 # iatom, nL, locrot 2 2 3 # L, qsplit, cix 0.80399554 -0.17441053 0.56848231 0.58179594 0.03313278 -0.81265965 0.12290101 0.98411543 0.12810995 4 1 -1 # iatom, nL, locrot 2 2 4 # L, qsplit, cix 0.80399554 -0.17441053 0.56848231 0.58179594 0.03313278 -0.81265965 0.12290101 0.98411543 0.12810995 #================ # Siginds and crystal-field transformations for correlated orbitals ================ 4 10 3 # Number of independent kcix blocks, max dimension, max num-independent-components 1 10 3 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- '(1/2,1)' '(3/2,1)' '(3/2,2)' 'z^2' 'x^2-y2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- -0.07403857 -0.34885775 -0.31067744 0.09883664 -0.00000000 -0.00000000 0.65478731 -0.00000000 0.07403857 0.34885775 -0.31903962 -0.00618930 -0.02900010 -0.05131462 -0.00000000 -0.00000000 -0.02900026 -0.05131445 0.31903962 0.00618930 0.31903969 -0.00618944 0.02900009 -0.05131475 0.00000000 0.00000000 0.02900024 -0.05131458 -0.31903969 0.00618944 -0.07403828 0.34885806 0.65478711 -0.00000000 0.00000000 0.00000000 -0.31067724 -0.09883629 0.07403828 -0.34885806 0.12601524 0.38669667 0.29006477 0.21599711 0.00000000 0.00000000 0.58384775 0.00000000 -0.12601524 -0.38669667 0.04124414 -0.10124465 0.01650992 -0.29415382 0.00000000 0.00000000 -0.01650993 0.29415379 -0.04124414 0.10124465 -0.04124399 -0.10124435 0.01650973 0.29415362 0.00000000 -0.00000000 -0.01650974 -0.29415360 0.04124399 0.10124435 0.12601503 -0.38669639 0.58384802 0.00000000 0.00000000 -0.00000000 0.29006532 -0.21599777 -0.12601503 0.38669639 -0.11015289 -0.28546915 0.79623534 -0.00000000 -0.00000000 0.00000000 0.08600015 0.19495357 0.11015289 0.28546915 -0.00000003 -0.00000013 0.06881626 0.29993903 -0.00000000 0.00000000 -0.07719616 0.18081883 0.00000003 0.00000013 -0.00000003 0.00000013 0.07719636 0.18081874 0.00000000 0.00000000 -0.06881605 0.29993954 0.00000003 -0.00000013 -0.11015303 0.28546922 0.08599969 -0.19495400 0.00000000 0.00000000 0.79623503 0.00000000 0.11015303 -0.28546922 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 10 3 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- '(1/2,1)' '(3/2,1)' '(3/2,2)' 'z^2' 'x^2-y2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- -0.07403857 -0.34885775 -0.31067744 0.09883664 -0.00000000 -0.00000000 0.65478731 -0.00000000 0.07403857 0.34885775 -0.31903962 -0.00618930 -0.02900010 -0.05131462 -0.00000000 -0.00000000 -0.02900026 -0.05131445 0.31903962 0.00618930 0.31903969 -0.00618944 0.02900009 -0.05131475 0.00000000 0.00000000 0.02900024 -0.05131458 -0.31903969 0.00618944 -0.07403828 0.34885806 0.65478711 -0.00000000 0.00000000 0.00000000 -0.31067724 -0.09883629 0.07403828 -0.34885806 0.12601524 0.38669667 0.29006477 0.21599711 0.00000000 0.00000000 0.58384775 0.00000000 -0.12601524 -0.38669667 0.04124414 -0.10124465 0.01650992 -0.29415382 0.00000000 0.00000000 -0.01650993 0.29415379 -0.04124414 0.10124465 -0.04124399 -0.10124435 0.01650973 0.29415362 0.00000000 -0.00000000 -0.01650974 -0.29415360 0.04124399 0.10124435 0.12601503 -0.38669639 0.58384802 0.00000000 0.00000000 -0.00000000 0.29006532 -0.21599777 -0.12601503 0.38669639 -0.11015289 -0.28546915 0.79623534 -0.00000000 -0.00000000 0.00000000 0.08600015 0.19495357 0.11015289 0.28546915 -0.00000003 -0.00000013 0.06881626 0.29993903 -0.00000000 0.00000000 -0.07719616 0.18081883 0.00000003 0.00000013 -0.00000003 0.00000013 0.07719636 0.18081874 0.00000000 0.00000000 -0.06881605 0.29993954 0.00000003 -0.00000013 -0.11015303 0.28546922 0.08599969 -0.19495400 0.00000000 0.00000000 0.79623503 0.00000000 0.11015303 -0.28546922 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 10 3 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- '(1/2,1)' '(3/2,1)' '(3/2,2)' 'z^2' 'x^2-y2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- -0.07403857 -0.34885775 -0.31067744 0.09883664 -0.00000000 -0.00000000 0.65478731 -0.00000000 0.07403857 0.34885775 -0.31903962 -0.00618930 -0.02900010 -0.05131462 -0.00000000 -0.00000000 -0.02900026 -0.05131445 0.31903962 0.00618930 0.31903969 -0.00618944 0.02900009 -0.05131475 0.00000000 0.00000000 0.02900024 -0.05131458 -0.31903969 0.00618944 -0.07403828 0.34885806 0.65478711 -0.00000000 0.00000000 0.00000000 -0.31067724 -0.09883629 0.07403828 -0.34885806 0.12601524 0.38669667 0.29006477 0.21599711 0.00000000 0.00000000 0.58384775 0.00000000 -0.12601524 -0.38669667 0.04124414 -0.10124465 0.01650992 -0.29415382 0.00000000 0.00000000 -0.01650993 0.29415379 -0.04124414 0.10124465 -0.04124399 -0.10124435 0.01650973 0.29415362 0.00000000 -0.00000000 -0.01650974 -0.29415360 0.04124399 0.10124435 0.12601503 -0.38669639 0.58384802 0.00000000 0.00000000 -0.00000000 0.29006532 -0.21599777 -0.12601503 0.38669639 -0.11015289 -0.28546915 0.79623534 -0.00000000 -0.00000000 0.00000000 0.08600015 0.19495357 0.11015289 0.28546915 -0.00000003 -0.00000013 0.06881626 0.29993903 -0.00000000 0.00000000 -0.07719616 0.18081883 0.00000003 0.00000013 -0.00000003 0.00000013 0.07719636 0.18081874 0.00000000 0.00000000 -0.06881605 0.29993954 0.00000003 -0.00000013 -0.11015303 0.28546922 0.08599969 -0.19495400 0.00000000 0.00000000 0.79623503 0.00000000 0.11015303 -0.28546922 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 10 3 # cix-num, dimension, num-independent-components #---------------- # Independent components are -------------- '(1/2,1)' '(3/2,1)' '(3/2,2)' 'z^2' 'x^2-y2' #---------------- # Sigind follows -------------------------- 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 #---------------- # Transformation matrix follows ----------- -0.07403857 -0.34885775 -0.31067744 0.09883664 -0.00000000 -0.00000000 0.65478731 -0.00000000 0.07403857 0.34885775 -0.31903962 -0.00618930 -0.02900010 -0.05131462 -0.00000000 -0.00000000 -0.02900026 -0.05131445 0.31903962 0.00618930 0.31903969 -0.00618944 0.02900009 -0.05131475 0.00000000 0.00000000 0.02900024 -0.05131458 -0.31903969 0.00618944 -0.07403828 0.34885806 0.65478711 -0.00000000 0.00000000 0.00000000 -0.31067724 -0.09883629 0.07403828 -0.34885806 0.12601524 0.38669667 0.29006477 0.21599711 0.00000000 0.00000000 0.58384775 0.00000000 -0.12601524 -0.38669667 0.04124414 -0.10124465 0.01650992 -0.29415382 0.00000000 0.00000000 -0.01650993 0.29415379 -0.04124414 0.10124465 -0.04124399 -0.10124435 0.01650973 0.29415362 0.00000000 -0.00000000 -0.01650974 -0.29415360 0.04124399 0.10124435 0.12601503 -0.38669639 0.58384802 0.00000000 0.00000000 -0.00000000 0.29006532 -0.21599777 -0.12601503 0.38669639 -0.11015289 -0.28546915 0.79623534 -0.00000000 -0.00000000 0.00000000 0.08600015 0.19495357 0.11015289 0.28546915 -0.00000003 -0.00000013 0.06881626 0.29993903 -0.00000000 0.00000000 -0.07719616 0.18081883 0.00000003 0.00000013 -0.00000003 0.00000013 0.07719636 0.18081874 0.00000000 0.00000000 -0.06881605 0.29993954 0.00000003 -0.00000013 -0.11015303 0.28546922 0.08599969 -0.19495400 0.00000000 0.00000000 0.79623503 0.00000000 0.11015303 -0.28546922 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 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