Characterization of OH species in kHz air/H2O atmospheric pressure dielectric barrier discharges

Cheng-Liang Huang, Tzu-Yi Liao, Yi-Ting He, Guan-Jung Lin, Wei-Hong Lai, Yi-Chi Chen, Kun-Mo Lin
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Abstract

This work numerically studies densities and mechanisms of OH species generated in atmospheric-pressure air dielectric barrier discharges with the model validated by experiments. The power consumption is measured, and the number of microdischarges (MDs) generated within a half period is captured by an intensified CCD camera. The OH densities of cases with various H2O concentrations are measured using ultraviolet absorption spectroscopy. The numerical model integrating the 1.5D discharge fluid model and 3D background gas model (BGM) is adopted to predict the MD behavior and the generation of species related to OH generation. The simulated OH densities cover the range of 1.1×10^19 and 1.6×10^19 m-3 in the cases studied, agreeing with those measured. The simulated results show that most OH radicals are generated in MDs, while the reactive section contributes around 2% of the total OH generation. The detailed analysis shows that atomic oxygen (O(1D) and O) and O3 contribute most of the OH generation in the MDs. In contrast, the self-association reactions (i.e., 2OH + M → H2O2 + M and 2OH → O + H2O) and NOx species consume more than 64% of OH radicals generated in MDs. In the BGM, it is interesting to find that reactive species NOx play significant roles in both the OH generation and depletion in the reactive section. The distributions of species related to the OH species obtained by the BGM are presented to elucidate the detailed chemistry of OH species in the reactive section.
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kHz 空气/H2O 常压介质势垒放电中 OH 物种的特征
这项研究以数值方法研究了大气压空气介质阻挡层放电中产生的 OH 物种的密度和机理,并通过实验验证了模型。测量了功耗,并通过增强型 CCD 摄像机捕捉了半周期内产生的微放电(MD)次数。使用紫外线吸收光谱测量了不同 H2O 浓度情况下的 OH 密度。采用集成了 1.5D 放电流体模型和 3D 背景气体模型 (BGM) 的数值模型来预测 MD 行为以及与 OH 生成相关的物种的生成。在所研究的情况下,模拟的 OH 密度范围为 1.1×10^19 和 1.6×10^19 m-3,与测量结果一致。模拟结果表明,大部分 OH 自由基是在 MD 中生成的,而反应部分约占 OH 生成总量的 2%。详细分析显示,原子氧(O(1D) 和 O)和 O3 是 MD 中产生 OH 的主要来源。相比之下,自偶联反应(即 2OH + M → H2O2 + M 和 2OH → O + H2O)和 NOx 物种消耗了 MD 中产生的 OH 自由基的 64% 以上。有趣的是,在 BGM 中,反应物 NOx 在反应部分的 OH 生成和消耗中都发挥了重要作用。通过 BGM 所得到的与 OH 物种相关的物种分布情况,可以阐明反应段中 OH 物种的详细化学性质。
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