DF Pseudopotential fit - CRYSTAL98 format ====================================== Element : Fe When : 17 Mar 08 INPUT 14.000 6 6 6 0 0 0 5.12237041 14.00000000 -1 2.51511645 -40.17016318 0 68.88205922 -1.31093574 0 8.04518971 233.53970769 1 11.87602774 -161.82652195 1 5.09693593 -1791.82033120 2 4.72210640 1599.45078669 2 1.70594204 1.03695301 2 1.98046097 26.70612465 0 129.99498266 0.57578912 0 2.39996246 3039.39666376 1 2.43500497 -3165.32503397 1 5.42607639 125.92837021 1 8.00515516 -291.65810402 2 5.38996549 391.88052787 2 21.57361672 27.51771082 2 2.73200743 624.99065580 0 8.14205971 -610.14663705 0 6.81776145 1017.89543597 1 25.88593190 -40.92293045 1 5.88766735 -976.97250552 1 3.94271278 -1433.26030940 2 2.68547503 -167.70300401 2 8.24853344 -1659.40792313 2