ANOMALOUS CENTRIFUGAL DISTORTION IN NH2
Author(s) -
L. H. Coudert,
Olivier Pirali,
MarieAline MartinDrumel
Publication year - 2017
Language(s) - English
Resource type - Conference proceedings
DOI - 10.15278/isms.2017.td03
Subject(s) - distortion (music) , computer science , environmental science , telecommunications , amplifier , bandwidth (computing)
The NH2 radical spectrum, first observed by Herzberg and Ramsay, a is dominated by a strong Renner-Teller effectb giving rise to two electronic states: the bent X B1 ground state and the quasi-linear A A1 excited state. The NH2 radical has been the subject of numerous high-resolution investigations and its electronic and ro-vibrational transitionsc have been measured. Using synchrotron radiation, new rotational transitions have been recently recorded and a value of the rotational quantum number N as large as 26 could be reached.d In the X B1 ground state, the NH2 radical behaves like a triatomic molecule displaying spin-rotation splittings. Due to the lightness of the molecule, a strong coupling between the overall rotation and the bending mode arises whose effects increase with N and lead to the anomalous centrifugal distortion evidenced in the new measurements. In this talk the Bending-Rotation approache developed to account for the anomalous centrifugal distortion of the water molecule is modified to include spin-rotation coupling and applied to the fitting of high-resolution data pertaining to the ground electronic state of NH2. A preliminary line position analysis of the available data c,d allowed us to account for 1681 transitions with a unitless standard deviation of 1.2. New transitions could also be assigned in the spectrum recorded by Martin-Drumel et al. In the talk, the results obtained with the new theoretical approach will be compared to those retrieved with a Watson-type Hamiltonian and the effects of the vibronic coupling between the ground X B1 and the excited A A1 electronic state will be discussed.
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