Notation and Energy of Electronic States

Notation and energy [eV] of electronic states (with respect to the potential curve minimum)
in energetic order for each multiplet system.

All numerical data are classified according
to this schema, separated into singlet and triplet system for all isotopomeres.

Singlet | Triplet | |||

n | Notation | Energy |
Notation | Energy |

1 | X^{ 1}Σ_{g}^{+} | 0 | ||

2 | B^{ 1}Σ_{u}^{+} | 11.36832 | b^{ 3}Σ_{u}^{+} | repulsive |

C^{ 1}Π_{u} | 12.41104 | c^{ 3}Π_{u} | 11.88862 | |

EF^{ 1}Σ_{g}^{+} | 12.41663 | a^{ 3}Σ_{g}^{+} | 11.89975 | |

3 | B'^{ 1}Σ_{u}^{+} | 13.84161 | e^{ 3}Σ_{u}^{+} | 13.36136 |

GK^{ 1}Σ_{g}^{+} | 13.91390 | d^{ 3}Π_{u} | 13.97927 | |

I^{ 1}Π_{g} | 14.01240 | h^{ 3}Σ_{g}^{+} | 13.98389 | |

J^{ 1}Δ_{g} | 14.06516 | g^{ 3}Σ_{g}^{+} | 14.00249 | |

D ^{ 1}Π_{u} | 14.12607 | i^{ 3}Π_{g} | 14.01098 | |

HH ^{ 1}Σ_{g}^{+} | 14.13676 | j^{ 3}Δ_{g} | 14.06354 | |

4 | B''B^{ 1}Σ_{u}^{+} | 14.62494 | f^{ 3}Σ_{u}^{+} | 14.46050 |

P^{ 1}Σ_{g}^{+} | 14.68251 | k^{ 3}Π_{u} | 14.68204 | |

R^{ 1}Π_{g} | 14.69390 | p^{ 3}Σ_{g}^{+} | no data | |

S^{ 1}Δ_{g} | 14.71741 | r^{ 3}Π_{g} | 14.69335 | |

D'^{ 1}Π_{u} | 14.74296 | s^{ 3}Δ_{g} | 14.71602 | |

O^{ 1}Σ_{g}^{+} | 14.74843 |