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首页> 外文期刊>Atmospheric Chemistry and Physics Discussions >Modeling the role of highly oxidized multifunctional organic?molecules for the growth of new particles over?the?boreal?forest?region
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Modeling the role of highly oxidized multifunctional organic?molecules for the growth of new particles over?the?boreal?forest?region

机译:建模高氧化多功能有机的作用?分子用于新颗粒的生长,α博族?森林?区域

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In this study, the processes behind observed new particle formation (NPF) events and subsequent organic-dominated particle growth at the Pallas Atmosphere–Ecosystem Supersite in Northern Finland are explored with the one-dimensional column trajectory model ADCHEM. The modeled sub-micron particle mass is up to ?~??75?% composed of SOA formed from highly oxidized multifunctional organic molecules (HOMs) with low or extremely low volatility. In the model the newly formed particles with an initial diameter of 1.5?nm reach a diameter of 7?nm about 2?h earlier than what is typically observed at the station. This is an indication that the model tends to overestimate the initial particle growth. In contrast, the modeled particle growth to CCN size ranges (???50?nm in diameter) seems to be underestimated because the increase in the concentration of particles above 50?nm in diameter typically occurs several hours later compared to the observations. Due to the high fraction of HOMs in the modeled particles, the oxygen-to-carbon (O??:??C) atomic ratio of the SOA is nearly 1. This unusually high O??:??C and the discrepancy between the modeled and observed particle growth might be explained by the fact that the model does not consider any particle-phase reactions involving semi-volatile organic compounds with relatively low O??:??C. In the model simulations where condensation of low-volatility and extremely low-volatility HOMs explain most of the SOA formation, the phase state of the SOA (assumed either liquid or amorphous solid) has an insignificant impact on the evolution of the particle number size distributions. However, the modeled particle growth rates are sensitive to the method used to estimate the vapor pressures of the HOMs. Future studies should evaluate how heterogeneous reactions involving semi-volatility HOMs and other less-oxidized organic compounds can influence the SOA composition- and size-dependent particle growth.
机译:在这项研究中,用一维列轨迹模型Adchem探索了观察到的新粒子形成(NPF)事件(NPF)事件(NPF)事件(NPF)事件(NPF)事件和随后的有机主导的颗粒生长。模型的亚微米颗粒质量由具有低或极低挥发性的高氧化多功能有机分子(HOMS)形成的SOA组成的SOA。在模型中,新形成的颗粒的初始直径为1.5≤nm,比在车站在车站上观察到的比例更早地达到7Ω·nm的直径。这表明该模型倾向于高估初始颗粒生长。相反,对CCN尺寸的建模颗粒生长似乎被低估了(直径为50·Nm),因为与观察结果相比,直径为50μm的颗粒浓度的增加通常发生几个小时。由于模拟颗粒中的高分母体,SOA的氧 - 碳(O-o ?? C)原子比几乎为1.这异常高O ?? C和之间的差异模型和观察到的颗粒生长可以通过该模型不考虑涉及具有相对低O的半挥发性有机化合物的任何颗粒相反的颗粒反应来解释:-?? C。在模型模拟中,低波动率和极低波动性HOM的凝结解释大部分SOA形成,SOA的相位状态(假设液体或无定形固体)对粒子数尺寸分布的演变具有微不足道的影响。然而,建模的颗粒生长速率对用于估计霍姆的蒸汽压力的方法敏感。未来的研究应该评估涉及半挥发性酸酐和其他少氧化有机化合物的异质反应如何影响SOA组成和尺寸依赖性颗粒生长。
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