• Title/Summary/Keyword: Photochemical behavior

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Quantification of Total Mercury in Antarctic Surface Snow using ICP-SF-MS: Spatial Variation from the Coast to Dome Fuji

  • Han, Yeong-Cheol;Huh, Young-Sook;Hong, Sung-Min;Hur, Soon-Do;Motoyama, Hideaki;Fujita, Shuji;Nakazawa, Fumio;Fukui, Kotaro
    • Bulletin of the Korean Chemical Society
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    • v.32 no.12
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    • pp.4258-4264
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    • 2011
  • The total mercury concentration ($Hg_T$) of surface snow samples collected along a ~1500 km transect in east Queen Maud Land was determined using inductively coupled plasma sector field mass spectrometry to address the behavior of Hg on the Antarctic Plateau. Due to the volatile nature of mercury, measures were taken against Hg loss from standard solutions by choosing appropriate container material and stabilizing agents. Glass bottles with Teflon-lined caps were superior to Teflon and polyethylene containers in protecting against Hg loss, but addition of gold chloride ($AuCl_3$) or bromine chloride (BrCl) was necessary to ensure preservation of Hg. As Hg loss was also observed in snowmelt samples, our analysis may underestimate the actual amount of HgT in the snow. Even so, the measured HgT was still very low (< 0.4-10.8 pg $g^{-1}$, n = 44) without a signal of depositional enhancement accompanying photo-oxidation of atmospheric elemental mercury in austral midsummer. Moreover, the dynamic variation along the traverse implies spatial and temporal heterogeneity in its source processes.

COMPUTER SIMULATION OF INTRAMOLECULAR HYDROGEN TRANSFER TO CARBONYL OXYGEN BY A MONTE CARLO METHOD: PHOTOREACTIONS VIA REMOTE PROTON TRANSFER IN BENZOYLBENZOATES

  • Hasegawa, Tadashi;Yamazaki, Yuko;Yoshioka, Michikazu
    • Journal of Photoscience
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    • v.4 no.2
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    • pp.61-67
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    • 1997
  • The model based on the idea that the p$_y$-orbital of the carbonyl oxygen is responsible to receiving hydrogen was devised for simulation of intramolecular hydrogen transfer. A Monte Carlo method was applied to free rotation of a molecular chain performed by changing the dihedral angles, and a "hit" was defined as the case when the migrating hydrogen comes within the region defined as the p$_y$-orbital and satisfies all the geometrical requirements for abstraction. A set of parameters was employed for defining the region and the requirements; $\tau$ was defined as the angle formed between O...H vector and its projection on the mean plane of the carbonyl group (- 43$\circ$ < $\tau$ < + 43$\circ$), $\Delta$ as the C=O...H angle (90 -15$\circ$ < $\Delta$ < 90 + 15$\circ$), $\theta$ as the O...H - C angle ( 180 - 80$\circ$< 0 < 180 + 80$\circ$), d as the distance from the center of the lobe of the p$_y$-orbital to hydrogen (0 < d < 1.04 ${\AA}$). The minimum value for the distance between carbonyl oxygen (O$_1$) and the migrating hydrogen (H$_i$) and for that between non-bonded atoms except the pair of O$_1$ and H$_i$ were assumed to be 0.52 ${\AA}$ and 1.54 ${\AA}$, respectively. The apphcation of this model to intramolecular $\beta$-, $\gamma$-, $\delta$-, $\epsilon$-, and $\zeta$-hydrogen abstraction in ketones and $\eta$- and $\theta$- proton transfer in oxoesters gave good results reflecting their photochemical behavior. The model was also used for prediction of photoreactivities of 2-(N,N-dibenzylamino)ethyl 2-, 3- and 4-benzoylbenzoate (1a - c). (1a - c).

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Computational Study on the Application of Porous Media to Fluid Flow in Exhaust Gas Scrubbers (배기가스 세정장치내 유체 유동에 대한 다공성 매질 적용 기반의 전산해석적 연구)

  • Hong, Jin-pyo;Yoon, Sang-hwan;Yoon, Hyeon-kyu;Kim, Lae-sung;An, Jun-tae
    • Journal of the Korean Society of Manufacturing Process Engineers
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    • v.21 no.2
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    • pp.1-10
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    • 2022
  • Exhaust gases emitted from internal combustion engines contain nitrogen oxides (NOx) and sulfur oxides (SOx), which are major air pollutants causing acid rain, respiratory diseases, and photochemical smog. As a countermeasure, scrubber systems are being studied extensively. In this study, the pressure drop characteristics were analyzed by changing the exhaust gas inflow velocity using a scrubber for a 700 kW engine as a model. In addition, the fluid flow inside the scrubber and the behavioral characteristics of the droplets were studied using CFD, and the design compatibility of the cleaning device was verified. Flow analysis was performed using inertial and viscous resistances by applying porous media to the complex shape of the scrubber. The speed of the exhaust passing through the outlet nozzle from the inlet was determined through the droplet behavior analysis by spraying, and the flow characteristics for the pressure drop were studied. In addition, it was confirmed through computational analysis whether there was a stagnation section in the exhaust gas flow in the scrubber or the sprayed droplets were in good contact with the exhaust gas.

Characteristics of long-term behavior of VOC species in Korea - PAMS data analysis (우리나라 휘발성유기화합물 화학종의 장기 거동 특성 - 광화학오염물질 측정자료 분석)

  • Park, Ji Hoon;Kang, Soyoung;Song, In-Ho;Lee, Dong-Won;Cho, SeogYeon
    • Journal of Korean Society for Atmospheric Environment
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    • v.34 no.1
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    • pp.56-75
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    • 2018
  • Korean Photochemical Assessment Monitoring Stations (PAMS) have been established since the late 2001 to monitor ambient air concentrations of VOC species, which would enhance understanding photo-chemical formation of ozone and subsequently contribute to developing efficient ozone control strategies. The present study aims at identifying major VOC species and examining their trends by analyzing PAMS monitoring data collected from the year 2006 to 2016. All the 18 PAMS sites operated by the Ministry of Environment were included in the study. PAMS monitored the 56 target VOC species, which are classified into four groups, alkenes, lower alkanes ($C{\leq}3$), higher alkanes ($C{\geq}4$), aromatics. The higher alkanes and aromatics dominated over the lower alkanes and alkenes in the type 2 and 3 PAMS sites except Joongheung site. N-butane was a major alkane species, toluene was a major aromatic species and most of VOCs showed decreasing trends in these sites. On the other hand, only the alkenes showed decreasing trends at the Joongheung site in Yeosu. Major sources of abundant species such as ethane, propane, n-butane, toluene were estimated by analyzing seasonal variations, correlation with other VOC species, and emission profiles. A major source of n-butane was identified as LPG cars, while major sources of toluene varied considerably from one site to another. The lower alkanes were composed of ethane and propane, both of which showed a strong seasonal variation, low in the summer and high in the winter, indicating that a major source might be the heating by gaseous fuels. Ozone formation potentials of VOC species were evaluated by applying MIR and POCP to the measured VOC species concentrations. Toluene contributed the most to total ozone forming potentials followed by m,p-xylene for all the type 2 and 3 PAMS sites except for two sites in Yeosu-Gwangyang. Ethylene and propylene were the first and second contributors to total ozone forming potentials at Joongheung site in Yeosu.

Synthesis and Characterization of Reactive Liquid Crystalline Compounds with Azo-mesogenic Groups at the 4-, 3,5-, or 3,4,5-Positions of Phenyl Ring (페닐고리의 4-, 3,5-, 또는 3,4,5-위치에 아조-메소젠기를 갖는 반응성 액정화합물의 합성 및 특성)

  • Park, Jong-Ryul;Yoon, Doo-Soo;Bang, Moon-Soo
    • Applied Chemistry for Engineering
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    • v.30 no.2
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    • pp.247-253
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    • 2019
  • In this study, compounds with azo-mesogenic groups at 4-, 3,5-, or 3,4,5-positions of one phenyl ring were synthesized, and their liquid crystallinity and photochemistry were investigated. The compounds in the Azo1 and Azo2 series had linear and planar geometries, respectively, while those in the Azo3 series had relatively bulky structures. Compounds of BA-Azo2 and BA-Azo3 did not show any liquid crystallinity. Compounds of BE-Azo1 and BE-Azo2 exhibited a monotropic liquid crystallinity, while the other compounds showed an enantiotropic liquid crystallinity. The liquid crystalline behavior was imparted by the azo-mesogenic groups, and most of the liquid crystalline compounds formed a smectic phase. All the RM-AzoX compounds exhibited photoisomerism because of the presence of the azo groups in the molecule. The rate of photoisomerization followed the order of RM-Azo3 < RM-Azo1 < RM-Azo2 and was considered to depend on the steric hindrance around the azobenzene groups in the molecule. These results suggest that the liquid crystallinity and photochemical property of the compounds are affected by the position or the number of azo-mesogenic groups phenyl ring of the molecule.

Investigation on Characteristics of High PM2.5 Pollution Occurred during October 2015 in Gwangju (광주 지역에서 2015년 10월에 발생한 PM2.5 고농도 사례 특성 분석)

  • Yu, Geun-Hye;Park, Seung-Shik;Jung, Sun A;Jo, Mi Ra;Lim, Yong Jae;Shin, Hye Jung;Lee, Sang Bo;Ghim, Young Sung
    • Journal of Korean Society for Atmospheric Environment
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    • v.34 no.4
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    • pp.567-587
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    • 2018
  • A severe haze event occurred in October 2015 in Gwangju, Korea. In this study, the driving chemical species and the formation mechanisms of $PM_{2.5}$ pollution were investigated to better understand the haze event. Hourly concentrations of $PM_{2.5}$, organic and elemental carbon, water-soluble ions, and elemental constituents were measured at the air quality intensive monitoring station in Gwangju. The haze event occurred was attributed to a significant contribution (72.3%) of secondary inorganic species concentration to the $PM_{2.5}$, along with the contribution of organic aerosols that were strongly attributed to traffic emissions over the study site. MODIS images, weather charts, and air mass backward trajectories supported the significant impact of long-range transportation (LTP) of aerosol particles from northeastern China on haze formation over Gwangju in October 2015. The driving factor for the haze formation was stagnant atmospheric flows around the Korean peninsula, and high relative humidity (RH) promoted the haze formation at the site. Under the high RH conditions, $SO{_4}^{2-}$ and $NO_3{^-}$ were mainly produced through the heterogenous aqueous-phase reactions of $SO_2$ and $NO_2$, respectively. Moreover, hourly $O_3$ concentration during the study period was highly elevated, with hourly peaks ranging from 79 to 95ppb, suggesting that photochemical reaction was a possible formation process of secondary aerosols. Over the $PM_{2.5}$ pollution, behavior and formation of secondary ionic species varied with the difference in the impact of LTP. Prior to October 19 when the influence of LTP was low, increasing rate in $NO_3{^-}$ was greater than that in $NO_2$, but both $SO_2$ and $SO{_4}^{2-}$ had similar increasing rates. While, after October 20 when the impact of haze by LTP was significant, $SO{_4}^{2-}$ and $NO_3{^-}$ concentrations increased significantly more than their gaseous precursors, but with greater increasing rate of $NO_3{^-}$. These results suggest the enhanced secondary transformation of $SO_2$ and $NO_2$ during the haze event. Overall, the result from the study suggests that control of anthropogenic combustion sources including vehicle emissions is needed to reduce the high levels of nitrogen oxide and $NO_3{^-}$ and the high $PM_{2.5}$ pollution occurred over fall season in Gwangju.