DF Pseudopotential fit - GAMESS format ====================================== Element : Ba When : 18 Nov 05 $ECP Ba-DFECP GEN 54 2 6 ..... Vd ..... 2.00000000 1 0.38412696 -4.35596135 2 0.33654835 1.08818379 2 0.88905392 -0.09405117 2 3.53543277 1.09405117 2 0.75960718 0.76825393 3 0.36347819 6 ..... Vs-Vd ..... 168622.79468199 2 0.44216336 -168621.08876596 2 0.35435223 1465041.56443254 2 0.36650973 -2039626.89070282 2 0.37218964 -194785.32501921 2 0.43921502 769371.65220121 2 0.38072770 6 ..... Vp-Vd ..... -996023.18377949 2 0.47846300 996024.32553678 2 0.55419471 -3591207.10158563 2 0.53993698 58000571.51378958 2 0.49765984 7119128.69377644 2 0.52053279 -61528492.10545449 2 0.49906474 $END