Beryllium Be2+ (valence electrons)

Oxygen O2− (valence electrons)

Wave functions 2Be2+ & 2O2−

Band gap (Γ-Γ) in eV

1

1s22s02p0

2s22p6

36

10.630

2

1s22s02p03p0

2s22p6

48

10.296

3

1s22s02p03p04p0

2s22p6

60

10.300

4

1s22s02p03p04p04s0

2s22p6

64

9.182

5

1s22s02p03p04p0

2s22p63s0

64

7.58

6

1s22s02p03p04p0

2s22p63p0

72

9.388 (Indirect)