S/N

ECUT (Ry)

ETOT (Ry)

1

12

−2391.11794851

2

16

−2405.62513615

3

20

−2412.08433421

4

24

−2415.06686281

5

28

−2416.41157927

6

32

−2416.43214121

7

36

−2417.28052871