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• W2955767551 abstract "We report the correction factors for centrifugal distortion in Raman intensities for pure rotation (O0- and S0-branch) and vibration–rotation (O1- and S1-branch) transitions in the ground electronic state of H2, HD and D2. These factors are presented for 52 selected excitation wavelengths and for the initial rotational states, J=2−21. This data is useful in applications of intensity calibration of spectrometers and the spectroscopy of flames. The classical treatment of centrifugal distortion involved the expansion of polarisability anisotropy (γ) over the internuclear distance, while assuming the diatomic molecule behaves as a harmonic oscillator. Here, this approximation of polarisability invariants as a Taylor series expansion is tested, revealing that truncation up to the second-order derivatives of mean polarisability (α¯) and polarisability anisotropy (γ) gives faithful representations, yielding accurate expectation values with error <0.2%, for the ground rovibrational state and for the fundamental transition." @default.
• W2955767551 created "2019-07-12" @default.
• W2955767551 creator A5034227537 @default.
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• W2955767551 date "2019-07-02" @default.
• W2955767551 modified "2023-10-15" @default.
• W2955767551 title "Vibration–rotation interactions in H₂, HD and D₂ : centrifugal distortion factors and the derivatives of polarisability invariants" @default.
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• W2955767551 doi "https://doi.org/10.1080/00268976.2019.1632950" @default.
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