CF3CFCH2and (Z)-CF3CFCHF: temperature dependent OH rate coefficients and global warming potentials

2008 ◽  
Vol 10 (6) ◽  
pp. 808-820 ◽  
Author(s):  
Vassileios C. Papadimitriou ◽  
Ranajit K. Talukdar ◽  
R. W. Portmann ◽  
A. R. Ravishankara ◽  
James B. Burkholder
2015 ◽  
Vol 17 (38) ◽  
pp. 25607-25620 ◽  
Author(s):  
Vassileios C. Papadimitriou ◽  
Christina S. Spitieri ◽  
Panos Papagiannakopoulos ◽  
Mathieu Cazaunau ◽  
Maria Lendar ◽  
...  

OH, Cl and O3 kinetics and IR spectra of (CF3)2CCH2 utilized to estimate tropospheric lifetimes, radiative efficiencies, global warming potentials, estimated photochemical ozone creation potentials and tropospheric oxidation end-products.


2015 ◽  
Vol 639 ◽  
pp. 145-150 ◽  
Author(s):  
Iustinian Bejan ◽  
Ian Barnes ◽  
Peter Wiesen ◽  
John C. Wenger

2017 ◽  
Author(s):  
Siripina Vijayakumar ◽  
Avinash Kumar ◽  
Balla Rajakuma

Abstract. Temperature dependent rate coefficients for the gas phase reactions of Cl atoms with 4-hexen-3-one and 5-hexen-2-one were measured over the temperature range of 298–363 K relative to 1-pentene, 1,3-butadiene and isoprene. Gas Chromatography (GC) was used to measure the concentrations of the organics. The derived temperature dependent Arrhenius expressions are k4-hexen-3-one+Cl (298–363 K) = (2.82 ± 1.76)×10−12exp [(1556 ± 438)/T] cm3 molecule−1 s−1 and k5-hexen-2-one+Cl (298–363 K) = (4.6 ± 2.4)×10−11exp[(646 ± 171)/T] cm3 molecule−1 s−1. The corresponding room temperature rate coefficients are (5.54 ± 0.41)×10−10 cm3 molecule−1 s−1 and (4.00 ± 0.37)×10−10 cm3 molecule−1 s−1 for the reactions of Cl atoms with 4-hexen-3-one and 5-hexen-2-one respectively. To understand the mechanism of Cl atom reactions with unsaturated ketones, computational calculations were performed for the reactions of Cl atoms with 4-hexen-3-one, 5-hexen-2-one and 3-penten-2-one over the temperature range of 275–400 K using Canonical Variational Transition state theory (CVT) with Small Curvature Tunneling (SCT) in combination with CCSD(T)/6-31+G(d, p)//MP2/6-311++G(d, p) level of theory. Atmospheric implications, reaction mechanism and feasibility of the title reactions are discussed in this manuscript.


2016 ◽  
Author(s):  
Anna Totterdill ◽  
Tamás Kovács ◽  
Wuhu Feng ◽  
Sandip Dhomse ◽  
Christopher J. Smith ◽  
...  

Abstract. Fluorinated compounds such as NF3 and C2F5Cl (CFC-115) are characterised by very large global warming potentials (GWPs) which result from extremely long atmospheric lifetimes and strong infrared absorptions in the atmospheric window. In this study we have experimentally determined the infrared absorption cross-sections of NF3 and CFC-115, calculated the radiative forcing and efficiency using two radiative transfer models and identified the effect of clouds and stratospheric adjustment. The infrared cross sections are in good agreement with previous measurements, whereas the resulting radiative forcings and efficiencies are, on average, around 10 % larger. A whole atmosphere chemistry-climate model was used to determine the atmospheric lifetimes of NF3 and CFC-115 to be (616 ± 34) years and (492 ± 22) years, respectively. The GWPs for NF3 are estimated to be 14 600, 19 400 and 21 400 over 20, 100 and 500 years, respectively. Similarly, the GWPs for CFC-115 are 6120, 8060 and 8630 over 20, 100 and 500 years, respectively.


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