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Radiative lifetimes of several low–lying doublet and quartet electronic states of diatomic boron carbide
Journal of Quantitative Spectroscopy and Radiative Transfer ( IF 2.3 ) Pub Date : 2020-05-23 , DOI: 10.1016/j.jqsrt.2020.107054
Shan Sun , Zunlue Zhu

Several experimental groups have measured the rovibrational transitions of B4Σ – X4Σ, 24Π – X4Σ, B4Σ – A4Π, and d2Σ+ – a2Π systems of diatomic boron carbide. However, no transition properties between any electronic states of this molecule have been calculated. This work studied the transition dipole moments between the X4Σ, A4Π, B4Σ, 14Δ, 14Σ+, and 24Π states, between the a2Π, b2Σ, c2Δ, and d2Σ+ states, and from the a2Π3/2 and a2Π1/2 states to the X4Σ3/2 and X4Σ1/2 states. The radiative lifetimes are on the order of 10–2 – 10–4 s for the 14Σ+ state, 10–3 – 10–4 s for the A4Π state, 10–4 s for the 14Δ state, 10–4 – 10–5 s for the c2Δ state, 10–5 s for the b2Σ and d2Σ+ states, and 10–7 s for the B4Σ and 24Π states. The B4Σ – X4Σ, 24Π – X4Σ, 24Π – A4Π, and 24Π – B4Σ transitions are strong. The transitions from the a2Π1/2 and a2Π3/2 states to the X4Σ1/2 and X4Σ3/2 states are weak. The emissions originating from the a2Π1/2 and a2Π3/2 states at higher vibrational levels are easier to measure than those at lower levels. The radiative lifetimes are approximately 100 – 103 and 100 – 102 s for the a2Π1/2 and a2Π3/2 states, respectively. The band origins, Franck–Condon factors, and Einstein A coefficients of all dipole–allowed transitions were calculated. The distribution of radiative lifetime varying with rotational angular quantum number was investigated for the A4Π, B4Σ, 24Π, b2Σ, and d2Σ+ states. The transition properties reported in this work can provide useful guidelines for future experimental and theoretical studies.



中文翻译:

双原子碳化硼几个低洼双峰和四重态电子态的辐射寿命

几个实验组已经测量B的振转跃迁4 Σ - - X 4 Σ -,2 4 Π - X 4 Σ -,B 4 Σ - -甲4 Π,和d 2 Σ + -一个2个Π系统双原子的硼碳化物。然而,尚未计算出该分子的任何电子状态之间的过渡性质。这项工作研究了X之间的跃迁偶极矩4 Σ -,A 4 Π,B 4 Σ -,1 4 Δ,14 Σ +,和2种4种Π状态,所述一个之间2 Π,B 2 Σ -,C 2 Δ,和d 2个Σ +状态,并且从一个2 Π 3/22个Π 1/2状态以的X 4 Σ - 3/2和X 4 Σ - 1/2的状态。的辐射寿命是10个量级-2 - 10 -4 S为1 4 Σ +状态,10 -3 - 10 -4S对于在A 4 Π状态,10 -4 S对于1个4 Δ状态,10 -4 - 10 -5 S对于与c 2 Δ状态,10 -5 S对于在B 2 Σ -和d 2个Σ +状态和10个-7 S为乙4 Σ -和2个4 Π状态。在B 4 Σ - - X 4 Σ -,2 4 Π - X 4 Σ -,2 4 Π -甲4 Π,和2 4Π - B 4 Σ -跃迁都很强。从一个过渡2 Π 1/22个Π 3/2状态到X 4 Σ - 1/2和X 4 Σ - 3/2状态是弱。排放从一个始发2 Π 1/22周Π 3/2在较高的振动能级的状态相比,是容易而以较低的水平来测量。a的辐射寿命约为10 0 – 10 3和10 0 – 10 2 s。2 Π 1/22个Π 3/2分别状态。计算了所有偶极允许跃迁的谱带起源,Franck-Condon因子和爱因斯坦A系数。辐射寿命的与旋转角度量子数改变分配进行了研究为A 4 Π,B 4 Σ -,2 4 Π,B 2 Σ - ,和d 2点Σ +的状态。这项工作中报告的过渡特性可以为将来的实验和理论研究提供有用的指导。

更新日期:2020-05-23
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