DF Pseudopotential fit - GAUSSIAN98 format ====================================== Element : Ti When : 17 Mar 08 Vd 8 1 22.29649672 10.00000000 2 6.07562013 -72305.15340277 2 7.08549167 72279.39956641 3 1.85317121 -5.38004642 3 11.48488557 228.34501358 4 6.58565089 72347.84359974 4 10.79509368 -36.31015055 4 4.36759114 524.90430538 Vs - Vd 8 2 1.90199524 -1486.27686725 2 3.17280244 1504.05739312 3 7.28185273 -346.63236251 3 1.60782556 297.60206194 3 31.70876802 49.03030057 4 2.57136209 1363.17044217 4 15.10326471 173.13661454 4 10.51280239 408.87838151 Vp - Vd 8 2 4.79017059 770.58828172 2 16.39428027 -760.06500844 3 2.73641831 4131.47101858 3 1.26533109 -2.86068712 3 2.75566672 -4128.61033146 4 13.54811035 -4681.55429918 4 3.18165696 -216.64417046 4 7.38011991 -3871.27097394