• Economic and Environmental Geology
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• v.41 no.6
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• pp.719-729
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• 2008

In this study, the speciation, adsorption, and transport of uranium in groundwater environments were simulated using geochemical models. The retarded transport of uranium by adsortption was effectively simulated using 3-D groundwater flow and reactive transport models. The results showed that most uranium was adsorbed(up to 99.5%) in a neutral pH(5.5$pCO_2(10^{-3.6}atm)$ condition. Under the higher $pCO_2(10^{-2.5}atm)$ condition, however, the pH range where most uranium was absorbed was narrow from 6 to 7. Under very low $pCO_2(10^{-4.5}atm)$ condition, uranium was mostly absorbed in the relatively wide pH range between 5.5 and 8.5. In the model including anion complexes, the uranium adsorption decreased by fluoride complex below the pH of 6. The results of this study showed that uranium transport is strongly affected by hydrochemical conditions such as pH, $pCO_2$, and the kinds and concentrations of anions($Cl^-$, ${SO_4}^{2-}$, $F^-$). Therefore, geochemical models should be used as an important tool to predict the environmental impacts of uranium and other hazardous compounds in many site investigations.

• Journal of Korean Society for Atmospheric Environment
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• v.19 no.3
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• pp.249-261
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• 2003

A three-dimensional mesoscale atmospheric dispersion modeling system consisting of the Lagrangian particle dispersion model (LPDM) and the meteorological mesoscale model (MM5) was employed to simulate the transport and dispersion of non-reactive pollutant during the nuclear spill event occurred from Sep. 31 to Oct. 3, 1999 in Tokaimura city, Japan. For the comparative analysis of numerical experiment, two more sets of foreign mesoscale modeling system; NCEP (National Centers for Environmental Prediction) and DWD (Deutscher Wetter Dienst) were also applied to address the applicability of air pollution dispersion predictions. We noticed that the simulated results of horizontal wind direction and wind velocity from three meteorological modeling showed remarkably different spatial variations, mainly due to the different horizontal resolutions. How-ever, the dispersion process by LPDM was well characterized by meteorological wind fields, and the time-dependent dilution factors ($\chi$/Q) were found to be qualitatively simulated in accordance with each mesocale meteorogical wind field, suggesting that LPDM has the potential for the use of the real time control at optimization of the urban air pollution provided detailed meteorological wind fields. This paper mainly pertains to the mesoscale modeling approaches, but the results imply that the resolution of meteorological model and the implementation of the relevant scale of air quality model lead to better prediction capabilities in local or urban scale air pollution modeling.

• Proceedings of the Korea Water Resources Association Conference
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• 2023.05a
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• pp.16-16
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• 2023

기후변화로 인한 가뭄, 홍수, 녹조 등 이상기후 현상들이 본격화함에 따라 안정적인 수자원 관리의 필요성이 증가하고 있다. 특히 급변하는 환경조건 속에서도 안정적인 수자원 확보를 가능하게 하는 지하수 자원의 적극적인 활용은 기후변화대응에 있어 핵심적인 요소이다. 지하수는 하천, 호수 연안지역 등 다양한 지표의 수문환경과 연결되어 천층지권의 수문생태적 특성을 결정하기 때문에, 지속가능한 수자원 활용을 위해서는 지하수와 지표수의 상호작용에 대한 통합적인 검토가 이루어져야 한다. 하지만 긴밀하게 연계된 특성에도 불구하고 지하수와 지표수에 대한 연구는 오랜기간 개별수문환경에 대해 독립적으로 수행되어왔다. 이러한 연구경향은 저류시간이 크게 다른 지하수와 지표수의 수문적 특성뿐 아니라 개별수문환경에서 나타나는 작용들을 통합적으로 다룰 수 있는 모델의 부제에도 기인한다. 최근 비약적인 연산능력의 향상과 함께 지하수-지표수 환경을 연계한 통합수문모델(Integrated Hydrology Model)의 개발 및 활용이 이루어짐에 따라 기후변화 및 수자원 활용에 따른 수문환경변화 대한 통합적인 연구 시도가 이루어지고 있다. 본 발표에서는 최근의 통합수문모델과 다중요소 반응성 운송 모형(Multicomponent Reactive Transport Model)의 연계를 통한 물질순환 연구의 최신 동향을 소개하고(농도-유량 상관관계, 지표수계의 화학적 풍화와 이산화탄소 저감, 녹조 등), 데이터 기반 모형을 통한 통합수문모델의 연산 효율 및 정확성 향상을 위한 방법에 대해 모색하고자 한다.

• Membrane and Water Treatment
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• v.14 no.2
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• pp.95-106
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• 2023

In the developing country like India, groundwater is the main sources for household, irrigation and industrial use. Its contamination poses hydro-geological and environmental concern. The hazardous waste sites such as landfills can lead to contamination of ground water. The contaminants existing at such sites can eventually find ingress down through the soil and into the groundwater in case of leakage. It is necessary to understand the process of migration of pollutants through sub-surface porous medium for avoiding health risks. On this backdrop, the present paper investigates the behavior of pollutants' migration through porous media. The laboratory experiments were carried out on a soil-column model that represents porous media. Two different types of soils (standard sand and red soil) were considered as the media. Further, two different solutes, i.e., non-reactive and reactive, were used. The experimental results are simulated through numerical modeling. The percentage variation in the experimental and numerical results is found to be in the range of 0.75- 11.23 % and 0.84 - 1.26% in case of standard sand and red soil, respectively. While a close agreement is observed in most of the breakthrough curves obtained experimentally and numerically, good agreement is seen in either result in one case.

• The Journal of Engineering Geology
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• v.20 no.4
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• pp.359-370
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• 2010

$CO_2$ leakage from a geological formation utilized for $CO_2$ storage could result in failure of the facility and threaten the environment, as well as human safety and health. A reactive transport model of a $CO_2-H_2O$-cement reaction was constructed to understand chemical changes in the case of $CO_2$ leakage through a cement crack in an injection well, which is the most probable leakage pathway during geological storage. The model results showed the dissolution of portlandite and CSH (calcium silicate hydrate) within the cement paste, and the precipitation of secondary CSH and calcite as the $CO_2$ plume migrated along the crack. Calcite occupied most of the crack after 3 year of reaction, which could be maintained until 30 years after crack development. The present results could be applied in the development of technology to prevent $CO_2$ leakage and to enhance the integrity of wells constructed for $CO_2$ geological storage.

• Environmental Engineering Research
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• v.25 no.4
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• pp.605-613
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• 2020

This study is to investigate the possibility of using activated carbon prepared from Iraqi date-pits (ADP) which are produced from palm trees (Phoenix dactylifera L.) as low-cost reactive material in the permeable reactive barrier (PRB) for treating lead (Pb⁺²) from the contaminated groundwater, and then compare the results experimentally with other common reactive materials such as commercial activated carbon (CAC), zeolite pellets (ZP). Factors influencing sorption such as contact time, initial pH of the solution, sorbent dosage, agitation speed, and initial lead concentration has been studied. Two isotherm models were used for the description of sorption data (Langmuir and Freundlich). The maximum lead sorption capacities were measured for ADP, CAC, and ZP and were found to be 24.5, 12.125, and 4.45 mg/g, respectively. The kinetic data were analyzed using various kinetic models particularly pseudo-first-order, pseudo-second-order, and intraparticle diffusion. COMSOL Multiphysics 3.5a depend on finite element procedure was applied to formulate transmit of lead (Pb⁺²) in the two-dimensional numerical (2D) model under an equilibrium condition. The numerical solution shows that the contaminant plume is hindered by PRB.

• Proceedings of the Korean Society of Soil and Groundwater Environment Conference
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• 2002.09a
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• pp.161-166
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• 2002

Bioremediation of trace metals in groundwater may require the manipulation of redox conditions via the injection of a carbon source. To simulate the numerous biogeochemical processes that will occur during the bioremediation of trace-metal-contaminated aquifers, a reactive transport model has been developed. The model consists of a set of coupled mass balance equations, accounting for advection, hydrodynamic dispersion, and a kinetic formulation of the biological or chemical transformations affecting an organic substrate, electron acceptors, corresponding reduced species, and trace metal contaminants of interest, uranium in this study. The redox conditions of the domain are characterized by estimating the pE, based on the concentrations of the dominant terminal electron acceptor and its corresponding reduced specie. This pE and the concentrations of relevant species we then used by a modified version of MINTEQA2, which calculates the speciation/sorption and precipitation/dissolution of the species of interest under equilibrium conditions. Kinetics of precipitation/dissolution processes are described as being proportional to the difference between the actual and calculated equilibrium concentration.

• Transactions of the Korean hydrogen and new energy society
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• v.22 no.3
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• pp.357-362
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• 2011

Complete mixture preparation of reactants prior to catalytic reforming is an enormously important step for successful operation of a fuel reformer. Incomplete mixing between fuel and reforming agents such as air and steam can cause temperature overshoot and deposit formation which can lead the failure of operation. For that purpose it is required to apply computational models describing coupled kinetics and transport phenomena in the mixing region, which are computationally expensive. Therefore, it is advantageous to analyze the gas-phase reaction kinetics prior to application of the coupled model. This study suggests one of the important design constraints, the required residence time in the mixing chamber to avoid substantial gas-phase reactions which can lead serious deposit formation on the downstream catalyst. The reactivity of various gaseous and liquid fuels were compared, then liquid fuels are far more reactive than gaseous fuels. n-Octane was used as a surrogate among the various hydrocarbons, which is one of the traditional liquid fuel surrogates. The conversion was slighted effected by reactants composition described by O/C and S/C. Finally, threshold residence times in the mixing region of a hydrocarbon reformer were studied and the mixing chamber is required to be designed to make complete mixture of reactants by tens of milliseconds at the temperature lower than $400^{\circ}C$.

• Proceedings of the Korean Vacuum Society Conference
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• 2014.02a
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• pp.221-221
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• 2014

The present work proposes an improved numerical simulator for design and modification of large area capacitively coupled plasma (CCP) processing chamber. CCP, as notoriously well-known, demands the tremendously huge computational cost for carrying out transient analyses in realistic multi-dimensional models, because electron dissociations take place in a much smaller time scale (${\Delta}t{\approx}10-8{\sim}10-10$) than time scale of those happened between neutrals (${\Delta}t{\approx}10-1{\sim}10-3$), due to the rf drive frequencies of external electric field. And also, for spatial discretization of electron flux (Je), exponential scheme such as Scharfetter-Gummel method needs to be used in order to alleviate the numerical stiffness and resolve exponential change of spatial distribution of electron temperature (Te) and electron number density (Ne) in the vicinity of electrodes. Due to such computational intractability, it is prohibited to simulate CCP deposition in a three-dimension within acceptable calculation runtimes (<24 h). Under the situation where process conditions require thickness non-uniformity below 5%, however, detailed flow features of reactive gases induced from three-dimensional geometric effects such as gas distribution through the perforated plates (showerhead) should be considered. Without considering plasma chemistry, we therefore simulated flow, temperature and species fields in three-dimensional geometry first, and then, based on that data, boundary conditions of two-dimensional plasma discharge model are set. In the particular case of SiH4-NH3-N2-He CCP discharge to produce deposition of SiNxHy thin film, a cylindrical showerhead electrode reactor was studied by numerical modeling of mass, momentum and energy transports for charged particles in an axi-symmetric geometry. By solving transport equations of electron and radicals simultaneously, we observed that the way how source gases are consumed in the non-isothermal flow field and such consequences on active species production were outlined as playing the leading parts in the processes. As an example of application of the model for the prediction of the deposited thickness uniformity in a 300 mm wafer plasma processing chamber, the results were compared with the experimentally measured deposition profiles along the radius of the wafer varying inter-electrode gap. The simulation results were in good agreement with experimental data.