Table 4 Calculated dissociation relationships of the Ω states of TlBr+ cation.
From: A theoretical investigation of spectroscopy properties and transition properties of TlBr+ cation
Ω state | Atomic state | Energy (cm−1) | |
|---|---|---|---|
This work | Expt32 | ||
Tl+(0) + Br(3/2) | 1/2, 3/2 | 0 | 0 |
Tl+(0) + Br(1/2) | 1/2 | 3421.87 | 3685.24 |
Tl(1/2) + Br+(2) | 1/2, 1/2, 3/2, 3/2, 5/2 | 48,684.96 | 46,018.89 |
Tl(1/2) + Br+(1) | 1/2, 1/2, 3/2 | 50,112.68 | 49,155.39 |
Tl(1/2) + Br+(0) | 1/2 | 50,600.33 | 49,856.29 |
Tl(3/2) + Br+(2) | 1/2, 1/2, 1/2, 1/2, 3/2, 3/2, 3/2, 5/2, 5/2, 7/2 | 52,179.53 | 53,811.59 |
Tl(3/2) + Br+(1) | 1/2, 1/2, 1/2, 3/2, 3/2, 5/2 | 54,784.90 | 56,948.09 |
Tl(3/2) + Br+(0) | 1/2, 3/2 | 57,859.69 | 57,648.99 |
