A hybrid variational-perturbation calculation of the ro-vibrational spectrum of nitric acid
Author:
Affiliation:
1. Department of Physics and Astronomy, University College London, London WC1E 6BT, United Kingdom
2. Department of Physics, Moscow State University of Civil Engineering (MGSU), Moscow, Russia
Funder
European Research Council (ERC)
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4913741
Reference88 articles.
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4. MIPAS database: Validation of HNO<sub>3</sub> line parameters using MIPAS satellite measurements
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1. Part 2:Validation for line lists generated for nitric acid (H14N16O3) for the ν1 band and its first two associated hot bands (ν1+ν9-ν9, ν1+ν7-ν7) in the 2.8 μm region, the ν1-ν9, ν1+ν9 and ν1+ν7 bands at 3.2 μm, 2.5 μm and 2.4 μm, respectively;Journal of Molecular Spectroscopy;2023-02
2. First investigation of the ν1, ν1-ν9, ν1+ν9, and ν1+ν7 absorption bands of nitric acid (1H14N16O3) at 3551.766 cm−1, 3092.708 cm−1, 4006.974 cm−1, and 4127.782 cm−1, respectively;Journal of Molecular Spectroscopy;2023-02
3. An evaluation for geometries, formation enthalpies, and dissociation energies of diatomic and triatomic (C, H, N, O), NO3, and HNO3 molecules from the PAW DFT method with PBE and optB88-vdW functionals;AIP Advances;2022-12-01
4. Molecular frames for a symmetry-adapted rotational basis set;Molecular Physics;2022-09-13
5. The 5.8 µm absorption bands for nitric acid (H14N16O3): line positions and intensities for the ν2 band at 1709.567 cm−1 and for its first associated hot bands (ν2+ν9−ν9, ν2+ν7−ν7, ν2+ν6−ν6);Molecular Physics;2021-11-13
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