Climate Metrics for C1-C4 Hydrofluorocarbons (HFCs)

被引:7
|
作者
Burkholder, James B. [1 ]
Marshall, Paul [2 ]
Bera, Partha P. [3 ,4 ]
Francisco, Joseph S. [5 ,6 ]
Lee, Timothy J. [3 ]
机构
[1] NOAA, Earth Syst Res Lab, Div Chem Sci, Boulder, CO 80305 USA
[2] Univ North Texas, Dept Chem, Denton, TX 76203 USA
[3] NASA, Ames Res Ctr, Mountain View, CA 94035 USA
[4] NASA, BAER Inst, Res Pk, Moffett Field, CA 94035 USA
[5] Univ Penn, Dept Earth & Environm Sci, Philadelphia, PA 19104 USA
[6] Univ Penn, Dept Chem, Philadelphia, PA 19104 USA
来源
JOURNAL OF PHYSICAL CHEMISTRY A | 2020年 / 124卷 / 23期
基金
美国国家航空航天局;
关键词
GAUSSIAN-BASIS FUNCTIONS; MOLECULAR CALCULATIONS;
D O I
10.1021/acs.jpca.0c02679
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
Hydrofluorocarbons (HFCs) are potent greenhouse gases that are potential substitutes for ozone depleting substances. The Kigali amendment lists 17 HFCs that are currently in commercial use to be regulated under the Montreal Protocol. Future commercial applications may explore the use of other HFCs, most of which currently lack an evaluation of their climate metrics. In this work, atmospheric lifetimes, radiative efficiencies (REs), global warming potentials (GWPs), and global temperature change potentials (GTPs) for all saturated HFCs with fewer than 5 carbon atoms are estimated to help guide future usage and policy decisions. Atmospheric lifetimes were estimated using a structure activity relationship (SAR) for OH radical reactivity and estimated O(D-1) reactivity. Radiative metrics were obtained using theoretically calculated infrared absorption spectra that were presented in a previous work. Calculations for some additional HFCs not included in the previous work were performed in this work. The HFCs display unique infrared spectra with strong absorption in the Earth's atmospheric infrared window region, primarily due to the C-F stretching vibration. Results from this study show that the HFC global atmospheric lifetimes and REs are dependent upon their H atom content and molecular structure. Therefore, the HFC radiative metric evaluation requires a case-by-case evaluation. A thorough experimental evaluation of a targeted HFC's atmospheric lifetime and climate metrics is always highly recommended. However, in cases where it is experimentally difficult to separate isomers, the new results from this study should help guide the experiments, as well as provide relevant climate metrics with uncertainties and policy relevant data.
引用
收藏
页码:4793 / 4800
页数:8
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