• Proceedings of the KSEEG Conference
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• 2000.04b
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• pp.264-265
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• 2000

• Economic and Environmental Geology
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• v.35 no.1
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• pp.13-23
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• 2002

The chemical compositions of groundwaters from the granite areas mainly belong to Ca-HC0$_{3}$ and Na-HC0$_{3}$type, and some of these belong to Ca-(CI+S0$_{4}$) and Na-(CI+S0$_{4}$) type. Spring waters and groundwaters from anorthosite areas belong to Ca-HC03 and Na-HC03 type, respectively. The result of reaction path modeling shows that the chemical compositions of aqueous solution reacted with granite evolve from initial Ca-CI type, via CaHC0$_{3}$ type, to Na-HC0$_{3}$ type. The result of rain water-anorthosite interaction is similar to evolution path of granite reaction and both of these results agree well with the field data. In the reaction path modeling of rain watergranite/anorthosite reaction, as a reaction is progressing, the activity of hydrogen ion decreases (pH increases). The concentrations of cations are controlled by the dissolution of rock-forming minerals and precipitation and re-dissolution of secondary minerals according to the pH. The continuous addition of granite causes the formation of secondary minerals in the following sequence; gibbsite plus hematite, Mn-oxide, kaolinite, silica, chlorite, muscovite (a proxy for illite here), calcite, laumontite, prehnite, and finally analcime. In the anorthosite reaction, the order of precipitation of secondary minerals is the same as with granite reaction except that there is no silica precipitation and paragonite precipitates instead of analcime. The silica and kaolinite are predominant minerals in the granite and anorthosite reactions, respectively. Total quantities of secondary minerals in the anorthosite reaction are more abundant than those in the granite reaction.

• Proceedings of the Korean Environmental Sciences Society Conference
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• 2002.05b
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• pp.195-197
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• 2002

• Proceedings of the KSEEG Conference
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• 2001.04a
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• pp.39-41
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• 2001

• Proceedings of the KSEEG Conference
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• 2001.04a
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• pp.12-15
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• 2001

• 한국석유지질학회:학술대회논문집
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• autumn
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• pp.4-4
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• 2000

• Proceedings of the Korean Information Science Society Conference
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• 2004.10a
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• pp.733-735
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• 2004

생명 현상을 시스템적으로 이해하기 위해서는 현상에 대한 수학적 모델링이 필수적이다. 여러 가지 수학적 모델 가운데 상미분 방정식(ODE) 모델은 여러 가지 생화학 반응을 모델링 하는데 널리 사용되고 있다. 본 논문에서는 신호전달 경로에 B형 간염 바이러스가 미치는 영향을 ODE로 모델링하고, 이를 시뮬레이션 한 결과를 보인다. 또한, ODE모델을 설계하는데 있어 보다 유연하고 확장 가능한 새로운 표현 방식을 제안한다.

• Economic and Environmental Geology
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• v.50 no.2
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• pp.85-96
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• 2017

Gold mineralization of Samjeong and Yongjang gold mines in Uichang area shows characteristics of Bonanza-type gold deposits. Ores are mainly developed along the contact parts between quartz vein and arkosic sandstone beds(Fe-rich bed) in sedimentary rock. Electrum, silver sulfide and sulfate minerals are mainly in the ores. On the other hand, gold mineralization is less developed in cherty rock and andesitic rock than arkosic sandstone. The study highlights characteristics of gold precipitation in the deposit on the basis of numerical modelling of the reactions between the assumed hydrothermal ore fluids with multicomponent heterogeneous equilibrium calculations. Aqueous species, gases and minerals, containing electrum are included in the calculations. The reaction result between hydrothermal ore fluids and arkosic sandstone show that pH increasing in the ore-forming fluid would trigger precipitation of quartz, chlorite, sericite, chalcopyrite, galena, pyrite, electrum, actinolite and feldspar. The numerical modelling also illustrates the drastic increase of pH and desulfidation lead to precipitation of electrum. Ag/Au ratios in the ore vary with pH conditions and subsequently precipitation of silver-bearing sulfides such as acanthite and polybasite. The modelling of the reaction between andesitic rock and ore-forming fluid shows that mineral assemblages of the case are analogous to ones of the reaction between arkosic sandstone and fluid except the latter has little portion of electrum. The abovementioned modelling results suggest that gold-silver mineralization is bounded by host rocks at the study area.

• 한국신재생에너지학회:학술대회논문집
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• 2010.06a
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• pp.106.1-106.1
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• 2010

석탄가스화기술은 매장량이 풍부하여 안정적인 공급이 보장되는 석탄을 이용함과 동시에 환경오염물질 감소라는 사회적 요구조건을 충족시키면서 화학제품, 석탄-가스화, 석탄-디젤화, 연료전지, 복합발전 등 다양한 분야에 응용이 가능한 장점이 있다. 특히 석탄가스화복합기술(Intergrated Coal Gasification Combined Cycle, IGCC)은 석탄을 고온, 고압하에서 가스화시켜 일산화탄소(CO), 수소($H_2$)가 주성분인 합성가스를 제조, 정제 후 가스터빈 및 증기터빈을 복합으로 구동하여 전기를 생산하는 친환경 차세대 발전기술로 주목을 받고 있다. 현재 IGCC 기술은 세계적으로 볼 때 상용화단계에 있고, 우리나라의 경우 한국형 IGCC 기술의 확보를 위한 연구사업이 진행중에 있다. 본 연구는 IGCC 발전플랜트의 발전효율을 결정하는 가장 중요한 부분이라 할 수 있는 가스화반응기의 모델링 기술을 개발하는 목적으로 진행되었다. 본 연구에서는 석탄가스화 반응기에서 발생하는 석탄의 휘발화와 Char의 표면반응 그리고 기상에서의 가스화반응등의 현상을 전산유체역학(Computational Fluid Dynamics)을 이용하여 모델링하는 방법론이 연구되었다. 해석을 위한 형상은 해석에 소요되는 시간을 줄이고, 형상이 해석결과에 미치는 영향을 줄이고자 2차원으로 구성하였다. 해석을 위한 수학적모델으로는 난류모델, 가스화반응모델, Lagrangian particle tracking, Char reaction 등을 포함하였고, 해석을 위한 Solver는 Fluent를 이용하였다. 모델링결과에 의해 예측되는 합성가스의 조성을 상용급 IGCC 가스화기의 운전결과와 비교해 본 결과 본 연구에서 설정한 모델로 예측되는 온도 및 가스농도가 실험치와 유사하게 나타남을 알 수 있었고 이를 통하여 본 연구에서 설정한 모델링방법이 적절함을 알 수 있었다.

• Korean Chemical Engineering Research
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• v.61 no.4
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• pp.598-603
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• 2023

Electrochemical ammonia production using catalysts offers a promising alternative to the conventional Haber-Bosch process, allowing for ambient temperature and pressure conditions, environmentally friendly operations, and high-purity ammonia production. In this study, we focus on the nitrogen reduction reactions occurring on the surfaces of ruthenium catalysts, employing first-principles calculations. By modeling reaction pathways for nitrogen reduction on the (0001) and (1000) surfaces of ruthenium, we optimized the reaction structures and predicted favorable pathways for each step. We found that the adsorption configuration of N₂ on each surface significantly influenced subsequent reaction activities. On the (0001) surface of ruthenium, the end-on configuration, where nitrogen molecules adsorb perpendicularly to the surface, exhibited the most favorable N₂ adsorption energy. Similarly, on the (1000) surface, the end-on configuration showed the most stable adsorption energy values. Subsequently, through optimized hydrogen adsorption in both distal and alternating configurations, we theoretically elucidated the complete reaction pathways required for the final desorption of NH₃.