DF Pseudopotential fit - GAUSSIAN98 format ====================================== Element : Cu When : 13 Oct 04 Vd 8 1 13.90418645 11.00000000 2 49.57109279 -59.09241364 2 2.44207811 -34.64540502 3 58.63970967 -33.37670998 3 11.16412767 186.32276098 4 3.65871317 93.51722848 4 0.52273561 -0.04810486 4 24.84063252 -3107.35142837 Vs - Vd 8 2 49.52913966 60.98873573 2 0.84098946 20.29639930 3 60.60862819 36.79631314 3 1.69866300 74.43644588 3 13.05633473 -111.23275902 4 2.58041980 -148.12639331 4 1.16349042 -23.09510280 4 24.95315835 3209.01016355 Vp - Vd 8 2 47.75648119 57.60180876 2 3.60855465 23.56858496 3 10.40585595 -172.49157790 3 6.81131707 106.46519429 3 22.04941377 66.02638361 4 2.29790865 -129.67845982 4 2.16772075 139.10313009 4 24.08164466 2826.48355326