DF Pseudopotential fit - CRYSTAL98 format ====================================== Element : Mo When : 13 Oct 04 INPUT 6.000 8 8 8 0 0 0 3.60943569 6.00000000 -1 0.82810148 -104.92095626 0 1.53061019 92.32696108 0 2.46067145 33.85023159 1 2.91818744 -12.19361748 1 1.02145281 49.10078497 2 1.55966810 22.96993969 2 3.92748036 -17.63933611 2 0.83517668 -97.04316179 0 1.47274934 107.58585513 0 3.82420048 22.04012529 1 1.65482860 20.77715890 1 2.91348216 -42.81728419 1 13.50272931 -1.55921374 2 1.02807022 56.78511078 2 3.90230053 22.17291391 2 1.36826341 -28611.77142493 0 0.99367673 28621.31844703 0 1.58915065 -1771.30613340 1 1.05726424 41085.40174456 1 1.03209861 -39314.09561115 1 3.00608723 101.29275557 2 1.21071751 -10802.61665542 2 56.90172562 -6.77807327 2