DF Pseudopotential fit - GAUSSIAN98 format ====================================== Element : Ca When : 13 Oct 04 Vd 8 1 2.50360938 2.00000000 2 2.07424178 -637.35584061 2 2.07862258 632.85249727 3 1.42373111 401.52394073 3 1.42539066 -396.51672197 4 0.62969813 -180889.53263265 4 0.62964688 181126.36453254 4 0.59935223 -243.40051986 Vs - Vd 8 2 0.78016126 1541.16884814 2 0.97908131 -1536.09637113 3 1.11885032 -1351.64035411 3 1.07379477 381.04090219 3 1.13673504 970.59945192 4 0.55456525 -285.92186269 4 0.89903484 -283.64747684 4 0.55003653 267.96631690 Vp - Vd 8 2 1.49300531 -112.73261066 2 1.55274755 116.68332039 3 1.83307475 1042.28564504 3 1.59793923 -65.38535245 3 1.84797631 -976.90029258 4 1.04465241 103.94978934 4 0.97633089 -967.11733752 4 0.96950632 876.03690221