Kinetic study of the OH plus ethylene reaction using frequency-modulated laser absorption spectroscopy

被引:9
作者
Lockhart, James P. A. [1 ]
Gross, Eisen C. [2 ]
Sears, Trevor J. [1 ,2 ]
Hall, Gregory E. [1 ]
机构
[1] Brookhaven Natl Lab, Div Chem, Upton, NY 11973 USA
[2] SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA
关键词
frequency modulation spectroscopy; hydroxyl radical; kinetics; master equation; MASTER EQUATION METHODS; GAS-PHASE REACTIONS; RATE CONSTANTS; HYDROXYL RADICALS; TEMPERATURE-DEPENDENCE; THERMAL-DECOMPOSITION; BIMOLECULAR REACTIONS; PRESSURE-DEPENDENCE; REACTION OH+C2H4; SHOCK-WAVES;
D O I
10.1002/kin.21265
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The pressure dependence of the OH + C2H4 addition reaction has been investigated using frequency-modulated laser absorption spectroscopy to monitor OH kinetics. Bimolecular rate coefficients for the title reaction are reported in argon bath gas at room temperature and total pressures ranging from 2 to 361 Torr. The pressure-dependent rate coefficients measured here agree well with the majority of published kinetic studies under similar conditions. Previous high-level ab initio calculations have identified a prereaction complex on the OH + C2H4 potential energy surface. The influence of this complex on the OH + C2H4 kinetics has been investigated using one-dimensional master equation analyses of the current and previous experimental measurements.
引用
收藏
页码:412 / 421
页数:10
相关论文
共 72 条
[31]   Theoretical Unimolecular Kinetics for CH4 + M ⇆ CH3 + H + M in Eight Baths, M = He, Ne, Ar, Kr, H2, N2, CO, and CH4 [J].
Jasper, Ahren W. ;
Miller, James A. .
JOURNAL OF PHYSICAL CHEMISTRY A, 2011, 115 (24) :6438-6455
[32]   PRESSURE-DEPENDENCE OF THE RATE CONSTANTS FOR THE REACTIONS OF C2H4 AND C3H6 WITH OH RADICALS AT 295 K [J].
KLEIN, T ;
BARNES, I ;
BECKER, KH ;
FINK, EH ;
ZABEL, F .
JOURNAL OF PHYSICAL CHEMISTRY, 1984, 88 (21) :5020-5025
[33]   Analysis of the A - X bands of the ethynyl radical near 1.48 μm and re-evaluation of (X)over-tildestate energies [J].
Le, A. T. ;
Gross, Eisen C. ;
Hall, Gregory E. ;
Sears, Trevor J. .
JOURNAL OF MOLECULAR SPECTROSCOPY, 2018, 349 :64-70
[34]   The near-infrared spectrum of ethynyl radical [J].
Le, Anh T. ;
Hall, Gregory E. ;
Sears, Trevor J. .
JOURNAL OF CHEMICAL PHYSICS, 2016, 145 (07)
[35]   KINETIC ISOTOPE EFFECTS IN THE GAS-PHASE REACTION OF HYDROXYL RADICALS WITH ETHYLENE IN THE TEMPERATURE-RANGE 343-1173-K AND AT 1-ATM PRESSURE [J].
LIU, AD ;
MULAC, WA ;
JONAH, CD .
JOURNAL OF PHYSICAL CHEMISTRY, 1988, 92 (13) :3828-3833
[36]   Theoretical study on mechanisms of the high-temperature reactions C2H3+H2O and C2H4+OH [J].
Liu, GX ;
Ding, YH ;
Li, ZS ;
Fu, Q ;
Huang, XR ;
Sun, CC ;
Tang, AC .
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2002, 4 (06) :1021-1027
[37]   RELATIVE RATE CONSTANTS FOR REACTION OF HYDROXYL RADICAL WITH A SERIES OF ALKANES, ALKENES, AND AROMATIC-HYDROCARBONS [J].
LLOYD, AC ;
DARNALL, KR ;
WINER, AM ;
PITTS, JN .
JOURNAL OF PHYSICAL CHEMISTRY, 1976, 80 (08) :789-794
[38]   Investigating the photodissociation of H2O2 using frequency modulation laser absorption spectroscopy to monitor radical products [J].
Lockhart, James P. A. ;
Gross, Eisen C. ;
Sears, Trevor J. ;
Hall, Gregory E. .
CHEMICAL PHYSICS LETTERS, 2018, 711 :148-151
[39]   Absolute OH concentration profiles measurements in high pressure counterflow flames by coupling LIF, PLIF, and absorption techniques [J].
Matynia, A. ;
Idir, M. ;
Molet, J. ;
Roche, C. ;
de Persis, S. ;
Pillier, L. .
APPLIED PHYSICS B-LASERS AND OPTICS, 2012, 108 (02) :393-405
[40]  
Medeiros DJ, 2018, PHYS CHEM CHEM PHYS, V20, P8984, DOI [10.1039/c8cp00091c, 10.1039/C8CP00091C]