Theoretical electronic structure with dipole moment and rovibrational calculation of the low-lying electronic states of the HgF molecule

Soumaya Elmoussaoui; Wael Chmaisani; Mahmoud Korek

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Theoretical electronic structure with dipole moment and rovibrational calculation of the low-lying electronic states of the HgF molecule

机译：具有偶极矩的理论电子结构和HGF分子低位电子状态的振动计算

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? For HgF molecule we investigated.

? Potential curves with dipole moment of 18 states with the constants Te, R e , ω e , De.

? Rovibrational parameters Ev, Bv, Dv and Rmin and Rmax.

? Einstein constants and Franck–Condon factor.

机译：<！[cdata [

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？用于我们调查的HGF分子。

？具有偶极矩的潜在曲线，其中18个状态为常量t E ，R E ，ω e ，d e 。

？ rovibrational参数e v ，b v ，d v 和r min 和r max 。？爱因斯坦常量和franck-condon因子。

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来源
《Journal of Quantitative Spectroscopy & Radiative Transfer》 |2017年第2017期|共11页
作者
Soumaya Elmoussaoui; Wael Chmaisani; Mahmoud Korek;
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作者单位

Beirut Arab University Faculty of Science;

Beirut Arab University Faculty of Science;

Beirut Arab University Faculty of Science;

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原文格式 PDF
正文语种 eng
中图分类光学;
关键词
Ab initio calculation; Electronic structure; Static and transition dipole moment; Ionic fraction; Einstein spontaneous emission constants; Vibrational levels; Franck–Condon factor;

机译：AB Initio计算;电子结构;静态和过渡偶极矩;离子分数;爱因斯坦自发排放常数;振动水平;Franck-Condon因子;

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1. Theoretical electronic structure with dipole moment and rovibrational calculation of the low-lying electronic states of the HgF molecule [J] . Soumaya Elmoussaoui, Wael Chmaisani, Mahmoud Korek Journal of Quantitative Spectroscopy & Radiative Transfer . 2017,第期

机译：具有偶极矩的理论电子结构和HGF分子低位电子状态的振动计算
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Theoretical electronic structure with dipole moment and rovibrational calculation of the low-lying electronic states of the HgF molecule

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