New Theoretical Infrared Line List for the Methyl Radical with Accurate Vibrational Band Origins from High-Level Ab Initio Calculations-Reference-Cited by-同舟云学术

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New Theoretical Infrared Line List for the Methyl Radical with Accurate Vibrational Band Origins from High-Level Ab Initio Calculations

Published:2022-09-08 Issue:37 Volume:126 Page:6429-6442
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Egorov Oleg¹^ORCID,Rey Michaël²^ORCID,Nikitin Andrei V.¹^ORCID,Viglaska Dominika²

Affiliation:

1. Laboratory of Theoretical Spectroscopy, V.E. Zuev Institute of Atmospheric Optics SB RAS 1, Akademician Zuev Sq., Tomsk 634055 Russia

2. Groupe de Spectrométrie Moléculaire et Atmosphérique UMR CNRS 7331, UFR Sciences BP 1039, 51687 Reims Cedex 2, France

Funder

Agence Nationale de la Recherche

Russian Science Foundation

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c04822

Reference103 articles.

1. Chemical Kinetics and Combustion Modeling

2. Effect of oxygen on methyl radical concentrations in a CH4/H2 chemical vapor deposition reactor studied by infrared diode laser spectroscopy

3. Determination of methyl radical concentrations in a methane/air flame by infrared cavity ringdown laser absorption spectroscopy

4. Study the effect of O2 addition on hydrogen incorporation in CVD diamond

5. Primary product channels in the photodissociation of methane at 121.6 nm

Cited by 4 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Rovibrational Line Lists of Triplet and Singlet Methylene;The Journal of Physical Chemistry A;2024-08-09

2. A numerical-tensorial “hybrid” nuclear motion Hamiltonian and dipole moment operator for spectra calculation of polyatomic nonrigid molecules;The Journal of Chemical Physics;2023-09-15

3. Accurate ab initio potential energy surface, rovibrational energy levels and resonance interactions of triplet (X~³B₁) methylene;Journal of Computational Chemistry;2023-09-08

4. High-level ab initio study of disulfur monoxide: Ground state potential energy surface and band origins for six isotopic species;Chemical Physics Letters;2023-01

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