HF

DFT

Excitation

Wavelength (nm)

Oscillator Strength (f)

Energy (eV)

Wavelength (nm)

Oscillator Strength (f)

Energy (eV)

Excited State 1

75 → 88

78 → 87

79 → 81

79 → 82

661.79

0.0056

1.8735

1507.07

0.0014

0.8227

Excited State 2

74 → 87

77 → 82

77 → 88

79 → 84

80 → 81

80 → 82

458.53

0.0314

2.7039

1056.31

0.0364

1.1738

Excited State 3

74 → 85

77 → 84

78 → 81

78 → 82

79 → 81

79 → 87

80 → 84

380.21

0.0021

3.2610

651.98

0.0000

1.9017