On the vibrational excitation of shock-heated air. I. CO/O2/Ar mixtures

D Dong He (School of Biomedical Sciences and Engineering, South China University of Technology, Guangzhou International Campus) X Xinkai Wei (Deep Space Exploration Laboratory/State Key Laboratory of High Temperature Gas Dynamics/Department of Modern Mechanics, University of Science and Technology of China 1 , Hefei 230026,) Q Qizhen Hong (State Key Laboratory of High Temperature Gas Dynamics, Institute of Mechanics, Chinese Academy of Sciences 1 , 100190 Beijing,) F Fernando Pirani (Dipartimento di Chimica, Biologia e Biotecnologie, Università di Perugia 2 , via Elce di Sotto 8, 06123 Perugia,) R Renjie Li (Songshan Lake Materials Laboratory) F Fei Li Q Quanhua Sun (State Key Laboratory of High Temperature Gas Dynamics, Institute of Mechanics, Chinese Academy of Sciences 1 , 100190 Beijing,) T Ting Si (Deep Space Exploration Laboratory, State Key Laboratory of High Temperature Gas Dynamics, Department of Modern Mechanics, University of Science and Technology of China 1 , Hefei 230026,) X Xisheng Luo (Deep Space Exploration Laboratory, State Key Laboratory of High Temperature Gas Dynamics, Department of Modern Mechanics, University of Science and Technology of China 1 , Hefei 230026,)

Abstract

This series of papers aims to investigate the vibrational excitation behaviors of shock-heated high-temperature air using the CO rovibrational thermometry. The present part of this series serves as a prerequisite for the work. The time-dependent rovibrational temperatures of CO were measured during the vibrational excitation process of CO/O2/Ar mixtures within the temperature range of 1680–2970 K and pressures of 1.37–2.43 bar to investigate the vibrational energy transfer between CO and O2. The state-to-state (StS) approach was employed in the simulations, where the vibrational energy levels of CO and O2 are treated as pseudo-species. The datasets of vibrational state-specific reactive and inelastic rate coefficients for CO + O2, O2 + Ar, and CO + O collisions were generated in this paper. The present StS simulations agreed well with the experimental data, whereas the Schwartz–Slawsky–Herzfeld (SSH) formula predicted faster CO vibrational temperatures. A sensitivity analysis was then performed and highlighted that the vibration–vibration (V–V) energy transfer between CO and O2 (τV−VCO−O2) is the key item inducing the discrepancies observed between the SSH results and experimental data. Therefore, a new expression was summarized for calculating τV−VCO−O2 based on the present experiments, and it also agreed well with the measured data in the literature at 100–700 K. In addition, the oxidation of CO and the effects of vibrational energy transfer between CO and O2 were discussed. Since differences in vibrational temperatures between CO and O2 were observed during the relaxation process, the refined rate of vibrational energy transfer between CO and O2 paves the way for the investigations in Part II.

Article Details

Volume / Issue Vol. 163, Issue 11
Published September 21, 2025
ISSN 0021-9606
Publisher American Institute of Physics

Journal Info

The Journal of Chemical Physics

American Institute of Physics

ISSN: 0021-9606 Physical Sciences

Authors (9)

D

Dong He

School of Biomedical Sciences and Engineering, South China University of Technology, Guangzhou International Campus

X

Xinkai Wei

Deep Space Exploration Laboratory/State Key Laboratory of High Temperature Gas Dynamics/Department of Modern Mechanics, University of Science and Technology of China 1 , Hefei 230026,

Q

Qizhen Hong

State Key Laboratory of High Temperature Gas Dynamics, Institute of Mechanics, Chinese Academy of Sciences 1 , 100190 Beijing,

F

Fernando Pirani

Dipartimento di Chimica, Biologia e Biotecnologie, Università di Perugia 2 , via Elce di Sotto 8, 06123 Perugia,

R

Renjie Li

Songshan Lake Materials Laboratory

F

Fei Li

Q

Quanhua Sun

State Key Laboratory of High Temperature Gas Dynamics, Institute of Mechanics, Chinese Academy of Sciences 1 , 100190 Beijing,

T

Ting Si

Deep Space Exploration Laboratory, State Key Laboratory of High Temperature Gas Dynamics, Department of Modern Mechanics, University of Science and Technology of China 1 , Hefei 230026,

X

Xisheng Luo

Deep Space Exploration Laboratory, State Key Laboratory of High Temperature Gas Dynamics, Department of Modern Mechanics, University of Science and Technology of China 1 , Hefei 230026,