DF Pseudopotential fit - CRYSTAL98 format ====================================== Element : Y When : 13 Oct 04 INPUT 3.000 8 8 8 0 0 0 2.56677533 3.00000000 -1 0.95012061 -8.55046079 0 4.75330452 1.99794002 0 1.02411194 13.15972987 1 0.86520829 -5.45940387 1 0.30704828 -0.05206729 2 1.28045383 -3.55720179 2 4.41273511 4.98211735 2 0.87389524 -207.28521032 0 0.44851229 214.01271306 0 0.78723330 1438.46947042 1 0.81641998 -1296.42778462 1 0.51175253 -142.04168580 1 0.85508386 -140.99755994 2 1.11890436 207.24119098 2 1.11526984 -151.40185839 2 0.92925549 17725.80671503 0 0.69748734 -17720.01756858 0 0.78522512 37.78178778 1 0.68288145 -190.72054632 1 0.65972476 152.93875853 1 0.87805614 2264.00326695 2 0.71024641 -19835.87117673 2 0.71238657 21684.18310369 2