DF Pseudopotential fit - GAUSSIAN98 format ====================================== Element : Fe When : 13 Oct 04 Vd 8 1 2.32750861 8.00000000 2 0.51295951 -0.24975566 2 12.66245546 -65.49153150 3 2.21666603 -1270.74645475 3 2.22863732 1289.36652361 4 21.60480668 1426.28919777 4 4.43179742 -154.29298736 4 18.57097907 -2101.40792547 Vs - Vd 8 2 1.20527178 -5.94672098 2 12.31834233 65.58327433 3 2.36540789 401.05559826 3 1.65453021 43.45230217 3 2.39078284 -444.50790043 4 24.75395516 -605.93800069 4 4.93834741 168.37677911 4 18.21940208 1238.27103106 Vp - Vd 8 2 0.97728936 -17.08736535 2 9.09827470 75.61239017 3 2.39614107 582.25123375 3 1.32094249 50.25202951 3 2.35158631 -632.50326326 4 25.75093951 -793.73924897 4 3.79316973 179.32354570 4 19.83252710 1285.65869960