The Radiative Efficiency and Global Warming Potential of HCFC-132b.

IF 2.3 3区 化学 Q3 CHEMISTRY, PHYSICAL
Chemphyschem Pub Date : 2025-01-02 Epub Date: 2024-12-04 DOI:10.1002/cphc.202400632
Daniela Alvarado-Jiménez, Andrea Pietropolli Charmet, Paolo Stoppa, Nicola Tasinato
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引用次数: 0

Abstract

Hydro-chloro-fluoro-carbons (HCFCs) are potent greenhouse gases which strongly absorb the infrared (IR) radiation within the 8-12 μm atmospheric windows. Despite international policies schedule their phasing out by 2020 for developed countries and 2030 globally, HCFC-132b (CH2ClCClF2) has been recently detected with significant atmospheric concentration. In this scenario, detailed climate metrics are of paramount importance for understanding the capacity of anthropogenic pollutants to contribute to global warming. In this work, the radiative efficiency (RE) of HCFC-132b is experimentally measured for the first time and used to determine its global warming potential (GWP) over 20-, 100- and 500-year time horizon. Vibrational- and rotational-spectroscopic properties of this molecule are first characterized by exploiting a synergism between Fourier-transform IR (FTIR) spectroscopy experiments and quantum chemical calculations. Equilibrium geometry, rotational parameters and vibrational properties predicted theoretically beyond the double-harmonic approximation are employed to assist the vibrational assignment of the experimental trace. Finally, FTIR spectra measured over a range of pressures are used to determine the HCFC-132b absorption cross section spectrum from 150 to 3000 cm-1, from which istantaneous and effective REs are derived and, in turn, used for GWP evaluation.

HCFC-132b 的辐射效率和全球升温潜能值。
氢氯氟碳化合物(HCFCs)是一种强效温室气体,能强烈吸收 8 - 12 μm 大气窗口内的红外线(IR)辐射。尽管国际政策规定发达国家到 2020 年、全球到 2030 年逐步淘汰 HCFC-132b(CH2ClCClF2),但最近仍检测到其在大气中的浓度很高。在这种情况下,详细的气候指标对于了解人为污染物导致全球变暖的能力至关重要。在这项工作中,首次通过实验测量了 HCFC-132b 的辐射效率 (RE),并用它来确定其在 20 年、100 年和 500 年时间跨度内的全球升温潜能值 (GWP)。通过利用傅立叶变换红外光谱(FTIR)实验和量子化学计算之间的协同作用,首次确定了该分子的振动和旋转光谱特性。平衡几何、旋转参数和双谐波近似理论预测的振动特性被用来辅助实验痕量的振动分配。最后,在一定压力范围内测量的傅立叶变换红外光谱用于确定 HCFC-132b 从 150 到 3000 cm-1 的吸收截面光谱,从中得出瞬时和有效的 REs,进而用于全球升温潜能值评估。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
Chemphyschem
Chemphyschem 化学-物理:原子、分子和化学物理
CiteScore
4.60
自引率
3.40%
发文量
425
审稿时长
1.1 months
期刊介绍: ChemPhysChem is one of the leading chemistry/physics interdisciplinary journals (ISI Impact Factor 2018: 3.077) for physical chemistry and chemical physics. It is published on behalf of Chemistry Europe, an association of 16 European chemical societies. ChemPhysChem is an international source for important primary and critical secondary information across the whole field of physical chemistry and chemical physics. It integrates this wide and flourishing field ranging from Solid State and Soft-Matter Research, Electro- and Photochemistry, Femtochemistry and Nanotechnology, Complex Systems, Single-Molecule Research, Clusters and Colloids, Catalysis and Surface Science, Biophysics and Physical Biochemistry, Atmospheric and Environmental Chemistry, and many more topics. ChemPhysChem is peer-reviewed.
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