10
1
mirror of https://github.com/pfloos/quack synced 2024-11-04 05:03:49 +01:00
QuAcK/examples/basis.Be.6-31g_star

24 lines
721 B
Plaintext

1 6
S 6
1 1264.5857000 0.0019448
2 189.9368100 0.0148351
3 43.1590890 0.0720906
4 12.0986630 0.2371542
5 3.8063232 0.4691987
6 1.2728903 0.3565202
S 3
1 3.1964631 -0.1126487
2 0.7478133 -0.2295064
3 0.2199663 1.1869167
P 3
1 3.1964631 0.0559802
2 0.7478133 0.2615506
3 0.2199663 0.7939723
S 1
1 0.0823099 1.0000000
P 1
1 0.0823099 1.0000000
D 1
1 0.4000000 1.0000000