• Title/Summary/Keyword: geochemical modelling

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Geochemical Modelling of the Effect of Calcite and Gypsum on the Hydration of Cements (방해석 및 석고가 시멘트 수화과정에 미치는 영향에 대한 지구화학 모델링 연구)

  • Ryu, Ji-Hun;Kim, Geon-Young;Koh, Yong-Kwon;Choi, Jong-Won
    • Journal of the Mineralogical Society of Korea
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    • v.23 no.2
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    • pp.151-159
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    • 2010
  • The effect of calcite and gypsum on the hydration of Portland cement was investigated using GEM-PSI, a geochemical model. Addition of calcite and gypsum up to 5 wt% of total cement clinker into Portland cement was found to influence the hydrate assemblage of the hydrated cement in different ways. The results of geochemical modelling showed that the fraction of calcium monocarbonate increased by the hydration of cement with the increase of calcite addition. The results of modelling also indicated that gypsum increased the fraction of ettringite in the assemblage of hydrated cement as the amount of gypsum added increases. This study showed that porosity generated by the hydration of cement had a significant relation with the amount of calcite and gypsum added. The porosity of hydrated cement was lower when calcite added up to 3 wt% of cement clinker compared to the hydrated cement with the same amount of gypsum addition. However, when calcite added more than 3% of cement clinker, the porosity of hydrated cement were higher than that of hydrated cement with the same amount of gypsum addition.

Numerical modelling of contaminant transport using FEM and meshfree method

  • Satavalekar, Rupali S.;Sawant, Vishwas A.
    • Advances in environmental research
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    • v.3 no.2
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    • pp.117-129
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    • 2014
  • Groundwater contamination is seeking a lot of attention due to constant degradation of water by landfills and waste lagoons. In many cases heterogeneous soil system is encountered and hence, a finite element model is developed to solve the advection-dispersion equation for layered soil system as FEM is a robust tool for modelling problems of heterogeneity and complex geometries. Recently developed Meshfree methods have advantage of eliminating the mesh and construct approximate solutions and are observed that they perform effectively as compared to conventional FEM. In the present study, both FEM and Meshfree method are used to simulate phenomenon of contaminant transport in one dimension. The results obtained are agreeing with the values in literature and hence the model is further used for predicting the transport of contaminants. Parametric study is done by changing the dispersion coefficient, average velocity, geochemical reactions, height of leachate and height of liner for obtaining suitability.

Reaction Path Modelling on Geochemical Evolution of Groundwater and Formation of Secondary Minerals in Water-Gneiss Reaction System (편마암-물 반응계에서 지하수의 지화학적 진화 및 이차광물 생성에 관한 반응경로 모델링)

  • 정찬호;김천수;김통권;김수진
    • Journal of the Mineralogical Society of Korea
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    • v.10 no.1
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    • pp.33-44
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    • 1997
  • The reaction path of water-gneiss in 200m borehole at the Soorichi site of Yugu Myeon, Chungnam was simulated by the EQ3NR/EQ6 program. Mineral composition of borehole core and fracture-filling minerals, and chemical composition of groundwater was published by authors. In this study, chemical evolution of groundwater and formation of secondary minerals in water-gneiss system was modelled on the basis of published results. The surface water was used as a starting solution for reaction. Input parameters for modelling such as mineral assemblage and their volume percent, chemical composition of mineral phases, water/rock ratio reactive surface area, dissolution rates of mineral phases were determined by experimental measurement and model fit. EQ6 modelling of the reaction path in water-gneiss system has been carried out by a flow-centered flow through open system which can be considered as a suitable option for fracture flow of groundwater. The modelling results show that reaction time of 133 years is required to reach equilibrium state in water-gneiss system, and evolution of present groundwater will continue to pH 9.45 and higher na ion concentration. The secondary minerals formed from equeous phase are kaolinite, smectite, saponite, muscovite, mesolite, celadonite, microcline and calcite with uincreasing time. Modeling results are comparatively well fitted to pH and chemical composition of borehole groudwater, secondary minerals identified and tritium age of groundwater. The EQ6 modelling results are dependent on reliability of input parameters: water-rock ratio, effective reaction surface area and dissolution rates of mineral phases, which are difficult parameters to be measured.

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Potential Contamination of Soil and Groundwater from the Residual Mine Tailings in the Restored Abandoned Mine Area : Shihung Mine Area (페광산 복구지역 잔류장미로 인한 주변 지하수${\cdot}$토양 오염가능성-시흥광산 사례)

  • 정예진;이상훈
    • Economic and Environmental Geology
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    • v.34 no.5
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    • pp.461-470
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    • 2001
  • The Shihung mine was restored in the early 90's after abandonment for 20 yews since 1973. Although disposed mine tailings were removed and the site was replaced by an incineration plant, still some residual mine tailings remain in the places including the old mine tailing ditposal area and the adjacent agricultural area. These residual mine tailings are prone to impose an adverse impact on the soil and groundwater and needs investigation for the potential contamination. Mine tailing samples were collected from the old tailing disposal area and the iii paddy. The porewater from the mine tailing were extracted and analysed to investigate chemical changes along the reaction path. Batch leaching tests were also carried out in the laboratory to find any supporting evidence found in the field analysis. Evidence of elemental leaching was confirmed both by the mine tailing and the porewater chemistry in them. The element concentrations of Cu, Cd, Pb, Zn in the porewater exceed the standard for drinking water of Korean government and US EPA. Leaching of heavy metals from the mine tailing seem to be responsible for the contamination. In batch leaching test. heavy metals were either continuous1y released or declined rapidly. Combining the information with porewater variation with depths and the geochemical meodeling results, most of elements are controlled by dissolution and/or precipitation processes, with some solubility controlling solid phases (Cu, Pb, Fe and Zn). Batch leaching test conducted at fixed pH 4 showed much higher releases for the heavy metals up to 400 times (Zn) and this area is becoming more vulnerable to soil and groundwater pollution as precipitation pH shifts to acidic condition.

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Conceptual Geochemical Modelling of Long-term Hyperalkaline Groundwater and Rock Interaction (지구화학 모델을 이용한 장기간의 강알칼리성 지하수-암석의 반응 개념 모델링)

  • Choi, Byoung-Young;Yoo, Si-Won;Chang, Kwang-Soo;Kim, Geon-Young;Koh, Yong-Kwon;Choi, Jong-Won
    • Journal of Nuclear Fuel Cycle and Waste Technology(JNFCWT)
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    • v.5 no.4
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    • pp.273-281
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    • 2007
  • Hyperalkaline groundwater formed by groundwater-cement components and its reaction with bedrock in a nuclear waste repository were simulated by geochemical modeling. The result of groundwater-cement components reaction showed that the pH of water was 13.3 and the precipitated minerals were Brucite, Katoite, Calcium Silicate Hydrate(CSH1.1), Ettringite, Hematite, and Portlandite. The result of interaction between such minerals and groundwater sampled in Gyeongju area also showed that the pH of groundwater reached 12.4. Interaction between such hyperalkaline groundwater and granite was simulated by kinetic model during $10^3$ years. This result showed that the final pH of groundwater reached 11.2 and the variation of pH was controlled by dissolution/precipitation of silicate and CSH minerals. Groundwater quality was also determined by dissolution/precipitation of silicate, CSH, oxide minerals. Our results show that geochemical modeling of long-term hyperalkaline groundwater and rock interaction can contribute to the safety assessment of engineered barrier by predicting geochemical condition in repository site.

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Geochemical Modeling on Water-caprock-gas Interactions within a CO2 Injected in the Yeongil Group, Pohang Basin, Korea (포항분지 영일층군 내 이산화탄소 주입에 의한 물-덮개암-가스 반응에 대한 지화학적 모델링)

  • Kim, Seon-ok;Wang, Sookyun;Lee, Minhee
    • Economic and Environmental Geology
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    • v.54 no.1
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    • pp.69-76
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    • 2021
  • This study is to identify the mineralogical properties of caprock samples from drilling cores of the Pohang basin, which is the research area for the demonstration-scale CO2 storage project in Korea. The interaction of water-rock-gas that can occur due to CO2 injection was identified using geochemical modeling. Results of mineralogical studies, together with petrographic data of caprock and data on the physicochemical parameters of pore water were used for geochemical modeling. Modelling was carried out using the The Geochemist's Workbench 14.0.1 geochemical simulator. Two steps of modeling enabled prediction of immediate changes in the caprocks impacted by the first stage of CO2 injection and the assessment of long-term effects of sequestration. Results of minerlaogical analysis showed that the caprock samples are mainly composed of quartz, K-feldspar, plagioclase and a small amount of pyrite, calcite, kaolinite and montmollonite. After the injection of carbon dioxide, the porosity of the caprock increased due to the dissolution of calcite, and dawsonite and chalcedony were precipitated as a result of the dissolution of albite and k-feldspar. In the second step after the injection was completed, the precipitation of dawsonite and chalcedony occurred as a result of dissolution of calcite and albite, and the pH was increased due to this reaction. Results of these studies are expected to be used as data to quantitatively evaluate the efficiency of mineral trapping capture in long-term storage of carbon dioxide.

An integrated studies for salt-water intrusion in Yeonggwang-gun, Korea

  • Hwang Seho;Chi Sejung;Lee Won-suk;Shin Jehyun;Park Inhwa;Huh Dae-Gee;Lee Sang-kyu
    • 한국지구물리탐사학회:학술대회논문집
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    • 2003.11a
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    • pp.455-458
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    • 2003
  • A combination of drilling, hydrogeochemical survey, geophysical survey and the numerical modelling for the flow and transport of groundwater was performed to evaluate the seawater intrusion in Baeksu-eup, Yeonggwang-gun, Korea. The survey area extends to over 24 $km^2$. Twelve wells were also drilled for the collection of geologic, geochemical, hydrologic, and geophysical logging data to delineate the degree and vertical extent of seawater intrusion. To evaluate and map the salinity in a coastal aquifer, geophysical data and hydrogeochemical results were used. Layer parameters derived from VES data, various in situ physical properties from geophysical well loggings, and the estimated equivalent NaCl concentration were used as the useful input parameters for the numerical simulation with density-dependent flow. Our multidisciplinary approach for evaluating the seawater intrusion can be considered as a valuable attempt to enhancing the utilization of various data and the reliability of numerical ground modelling.

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Geochemical Characteristics of Soil Solution from the Soil Near Mine Tailing Dumps and the Contamination Assessment in Duckum Mine (토양수의 자구화학특성에 따른 금속폐광산 광미야적장주변 토양오염평가: 덕음광산)

  • 이상훈;정주연
    • Economic and Environmental Geology
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    • v.37 no.1
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    • pp.61-72
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    • 2004
  • The soil samples were collected from the paddy field near the mine tailing dumps in the abandoned Duckum mine in Korea. In the laboratory, the soil solution was extracted from the soil using centrifuge, and analysed for the chemical composition. Physical and chemical soil properties were also analysed. Kaolinite is the main clay minerals in the paddy soil and the CEC value is therefore relatively low. Nearly all soil samples show enrichment in their trace elemental concentrations(Cd, Cu, Pb and Zn) compared with natural background level. Some soil samples exceed the soil remediation intervention values for Cd, Pb and Zn and target value for Cu, when compared with Dutch standard, whereas As, Ni and Cr are in normal range. Lead concentrations in some samples near the mine tailing dumps also exceed the standard for remediation act for agricultural area set by Korean soil conservation law. The trace elemental concentrations are higher in the paddy soil nearer the mine tailing dumps and lower for the samples from distance. Similar trend with distance is found for the soil solution chemistry but the decrease with distance from the mine tailing dumps are sharper than the changes in soil chemistry. Cadmium, Cu and Pb concentrations in the soil solution are very low, ranging from a tenth and hundredths to a maximum of several mg/l, whereas their concentrations in soils are highly enriched for natural background. Most of the trace elements are thought to be either removed by reduced iron sulphides or iron oxides, depending on the redox changes. Geochemical equilibrium modelling indicate the presence of solubility controlling solid phases for Cd and Pb, whereas Zn and Cu might have been controlled by adsorption/desorption processes. Although pollutants migration through solution phase are thought to be limited by adsorption onto various Fe, Mn solid phases, the pollutants exist as easily releasable fractions such as exchangeable site. In this case, the paddy soil would act as pollutant pool, which will supply to plants in situ. whenever the geochemical conditions favour.

Geochemical Reactive Experimental and Modeling Studies on Caprock in the Pohang Basin (포항분지 덮개암에 대한 지화학적 반응 실험 및 모델링 연구)

  • Kim, Seon-ok;Wang, Sookyun;Lee, Minhee
    • Economic and Environmental Geology
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    • v.49 no.5
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    • pp.371-380
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    • 2016
  • This study aims to identify the mineraloical and petrographical characteristics of caprock from drilling cores of Pohang basin as a potential $CO_2$ storage site. Experiments and modeling were conducted in order to investigate the geochemical and mineralogical caprock effects of carbon dioxide. A series of autoclave experiments were conducted to simulate the interaction in the $scCO_2$-caprock-brine using a high pressure and temperature cell at $50^{\circ}C$ and 100 bar. Geochemical and mineralogical alterations after 15 days of $scCO_2$-caprock-brine sample reactions were quantitatively examined by XRD, XRF, ICP-OES investigation. Results of mineralogical studies, together with petrographic data of caprock and data on the physicochemical parameters of brine were used for geochemical modeling. Modelling was carried out using the The Geochemist's Workbench 11.0.4 geochemical simulator. Results from XRD analysis for caprock sample showed that major compositional minerals are quartz, plagioclase, and K-feldspar, and muscovite, pyrite, siderite, calcite, kaolinite and montnorillonite were included on a small scale. Results from ICP-OES analysis for brine showed that concentration of $Ca^{2+}$, $Na^+$, $K^+$ and $Mg^{2+}$ increased due to dissolution of plagioclase, K-feldspar and muscovite. Results of modeling for the period of 100 years showed that the recrystallization of kaolinite, dawsonite and beidellite, at the expense of plagioclase and K-feldspar is characteristic. Volumes of newly precipitation minerals and minerals passing into brine were balanced, so the porosity remained nearly unchanged. Experimental and modeling results indicate the interaction between caprock and $scCO_2$ during geologic carbon sequestration can exert significant impacts in brine pH and solubility/stability of minerals.

Genesis of Bonanza-style Ores in Uichang Area, Changwon City: Geochemical Interpretation by Reaction Path Modeling (창원시 의창지역 보난자형 금광상 성인 : 반응경로 모델링에 의한 지구화학적 해석)

  • Lee, Seung-han;No, Sang-gun;Park, Maeng-Eon
    • 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.