水文地球化学模拟研究的现状

水文地球化学模拟是研究地质生态，地下水污染的一种新的方法，是多学科综合研究的产物，通过各种不同的水文地球化学模型，可以定量模拟各种自然过程和人类活动影响下水－岩相互作用及地下水中污染质的运移过程，预测地下水污染的发生，发展趋势，指导地地下水的监测，保护及合理开采，是地下水管理中不可缺少的一部分。综述了有关水文地球化学模拟研究的现状，对水溶液组分平衡的地球化学模型，地下水溶质运移模型，耦合水化学模型     

河源市中心城区土壤环境地球化学特征研究

对广东省河源市中心城区的表层土壤进行了取样调查工作,测定了金属元素的含量,并对其污染状况进行评价,数据表明:城区表层土壤存在多种重金属元素异常,其中Pb和As表现出富集特征,来源指向汽车尾气及其它工业活动的排放。重金属含量要明显低于其它大城市,该市环境风险指数(IER)为0.43,属于2级指数范畴,总体评价为低环境风险,但作为一个主要以轻工业、农业和旅游业为主的城市,也存在进一步恶化的趋势。     

塔里木南缘铁克里克地区西段晚古生代辉绿岩LA-ICP-MS锆石U-Pb定年及其地质意义

新疆塔里木南缘铁克里克地区西段出露的古元古代都维吐卫花岗岩体中大量发育辉绿岩脉, 多呈岩墙、 岩株状产出。岩石地球化学研究表明, 辉绿岩来自EMI型地幔源区, 形成于大陆板内裂解环境。辉绿岩的LA-ICP-MS 锆石U-Pb同位素年龄为408.5±7.3Ma, 属于早泥盆世。结合西昆仑造山带中一系列早古生代花岗质岩体, 推测该辉绿岩的形成表明原特提斯洋的闭合时间应早于早泥盆世, 代表了原特提斯洋构造旋回的结束, 为探讨早古生代塔里木南缘的构造演化提供了新的资料。     

Geochemical and flow modelling as tools in monitoring managed aquifer recharge

Due to a growing world population and the effects of anthropogenic climate change, access to clean water is a growing global concern. Managed aquifer recharge (MAR) is a method that can help society's response to this increasing demand for pure water. In MAR, the groundwater resources are replenished and the quality of the recharged surface water is improved through effects such as the removal of organic matter. This removal occurs through mechanisms such as microbial decomposition, which can be monitored by studying the isotopic composition of dissolved inorganic carbon (DIC). Nevertheless, the monitoring can be difficult when there are other factors, like dissolving calcite, affecting the isotopic composition of DIC.The aims of this study were to establish a method for monitoring the decomposition of organic matter (dissolved organic carbon – DOC) in cases where calcite dissolution adds another component to the DIC pool, and to use this method to monitor the beginning and amount of DOC decomposition on a MAR site at Virttaankangas, southwestern Finland. To achieve this, we calculated the mean residence times of infiltrated water in the aquifer and the fractions of this water reaching observation wells. We conducted geochemical modelling, using PHREEQC, to estimate the amount of DOC decomposition and the mineral reactions affecting the quality of the water.     

Crystallization behavior of Na2SO4–MgSO4 salt mixtures in sandstone and comparison to single salt behavior

We report on the crystallization behavior and the salt weathering potential of Na₂SO₄, MgSO₄ and an equimolar mixture of these salts in natural rock and porous stone. Geochemical modeling of the phase diagram of the ternary Na₂SO₄–MgSO₄–H₂O system was used to determine the equilibrium pathways during wetting (or deliquescence) of incongruently soluble minerals and evaporation of mixed electrolyte solutions. Model calculations include stable and metastable solubilities of the various hydrated states of the single salts and the double salts Na₂Mg(SO₄)₂·4H₂O (bloedite), Na₂Mg(SO₄)₂·5H₂O (konyaite), Na₁₂Mg₇(SO₄)₁₃·15H₂O (loeweite) and Na₆Mg(SO₄)₄ (vanthoffite). In situ Raman spectroscopy was used to study the phase transformations during wetting of pure MgSO₄·H₂O (kieserite) and of the incongruently soluble salts bloedite and konyaite. Dissolution of kieserite leads to high supersaturation resulting in crystallization of higher hydrated phases, i.e. MgSO₄·7H₂O (epsomite) and MgSO₄·6H₂O (hexahydrite). This confirms the high damage potential of magnesium sulfate in salt damage of building materials. The dissolution of the incongruently soluble double salts leads to supersaturation with respect to Na₂SO₄·10H₂O (mirabilite). However, the supersaturation was insufficient for mirabilite nucleation. The damage potential of the two single salts and an equimolar salt mixture was tested in wetting–drying experiments with porous sandstone. While the high damage potential of the single salts is confirmed, it appears that the supersaturation achieved during wetting of the double salts at room temperature is not sufficient to generate high crystallization pressures. In contrast, very high damage potentials of the double salts were found in experiments at low temperature under high salt load.1     

Arsenic mobilization in an oxidizing alkaline groundwater: Experimental studies,comparison and optimization of geochemical modeling parameters

Arsenic (As) mobilization and contamination of groundwater affects millions of people worldwide. Progress in developing effective in-situ remediation schemes requires the incorporation of data from laboratory experiments and field samples into calibrated geochemical models.In an oxidizing aquifer where leaching of high pH industrial waste from unlined surface impoundments led to mobilization of naturally occurring As up to 2 mg L⁻¹, sequential extractions of solid phase As as well as, batch sediment microcosm experiments were conducted to understand As partitioning and solid-phase sorptive and buffering capacity. These data were combined with field data to create a series of geochemical models of the system with modeling programs PHREEQC and FITEQL. Different surface complexation modeling approaches, including component additivity (CA), generalized composite (GC), and a hybrid method were developed, compared and fitted to data from batch acidification experiments to simulate potential remediation scenarios. Several parameters strongly influence the concentration of dissolved As including pH, presence of competing ions (particularly phosphate) and the number of available sorption sites on the aquifer solids. Lowering the pH of groundwater to 7 was found to have a variable, but limited impact (<63%) on decreasing the concentration of dissolved As. The models indicate that in addition to lowering pH, decreasing the concentration of dissolved phosphate and/or increasing the number of available sorption sites could significantly decrease the As solubility to levels below 10 μg L⁻¹. The hybrid and GC modeling results fit the experimental data well (NRMSE<10%) with reasonable effort and can be implemented in further studies for validation.     

江西沟1号风成剖面地球化学元素特征及古环境意义

通过对江西沟风成沉积剖面的地球化学分析,并结合OSL年代、粒度和磁化率数据,探讨了末次冰消期以来青海湖南岸气候的演变。剖面常量元素氧化物含量呈SiO_2Al_2O_3CaOFe_2O_3MgOK_2ONa_2O变化特征,常量元素氧化物及化学元素综合参数与地层有较好的对应性。不同的环境指标对气候变化的敏感性不同,总体上看,地球化学元素的敏感性高,全新世以来粒度和磁化率的变幅较小,即使在全新世大暖期,其值变化都很小。地球化学元素记录所反映的气候变化过程如下。Ⅰ.末次冰消期~12 ka BP,13.2 ka BP前总体上呈相对温暖状态,可能受B/A暖期的影响,13.2~12 ka BP气候不断向干冷方向发展,寒冷程度不断加剧并在12 ka BP达到最强,可能反映出12 ka BP左右的新仙女木事件;Ⅱ.12~9 ka BP,气候呈波动回升状态,暖湿程度呈增加趋势,表现出温凉的气候变化特征;Ⅲ.9~4.5 ka BP,气候温暖湿润,与全新世大暖期相对应,该阶段水热组合达到最佳,但存在阶段性的变化;Ⅳ.4.5~2 ka BP,气候总体向冷干方向转变,3 ka BP前变化幅度较小,气候较温暖湿润,3~2 ka BP气候凉偏干。     

The Soil Geochemical Atlas of Portugal: Overview and applications

The continental area of Portugal is now entirely covered by a soil geochemical survey (1 site/135 km²), taking as the sampling media topsoils (upper mineral horizons, A) and organic horizons (humus, O). Standard methods for sampling, sample preparation and analysis were used in order to achieve high quality and consistent data. Each sample was analyzed for 32 chemical elements, pH, electrical conductivity and organic matter content.The main purpose of the survey was to obtain baseline levels for various chemical elements. The compilation of all data (nearly 45,000 individual data) in an organised way, led to the production of the first Soil Geochemical Atlas of Portugal. In this Atlas it is possible to find for each chemical element a set of information statistics (basic statistical parameters, boxplots, cumulative frequency curves, etc.), maps of spatial distribution, among other information of geochemical and environmental interest. This paper gives an overview of the Soil Atlas and examples of application. The data were used to calculate reference values for 9 elements of environmental importance and to obtain empirical formulae allowing the estimation of elements in the coarse fraction of soils (< 2.00 mm) from known concentration in a finer fraction (< 0.18 mm).     

Geochemistry of post-collisional mafic lavas from the North Anatolian Fault zone, Northwestern Turkey

Extensive magmatic activity developed at the northwestern part of the Anatolian block and produced basaltic lavas that are situated along and between the two segments of the North Anatolian Fault zone. This region is a composite tectonic unit formed by collision of continental fragments after consumption of Neotethyan ocean floor during the late Cretaceous. Northwestern Anatolian basalts and evolved lavas exhibit both tholeiitic and calc-alkaline characteristics. Mafic lavas are moderately enriched in LILE (except depleted part of Yuvacık and İznik samples) and depleted in HFSE (but not Zr, Hf) relative to primitive mantle values, suggesting derivation from a MORB-like mantle source that is unexpected in this subduction environment. Sr and Nd isotopes are close to the mantle array and vary beyond analytical error (⁸⁷Sr/⁸⁶Sr 0.70404–0.70546, ¹⁴³Nd/¹⁴⁴Nd 0.51270–0.51289). These geochemical features may result from two possible processes: (1) melting of a MORB-like mantle source that was modified by subduction-released fluids and melts or (2) modification of mafic liquids derived from a dominantly MORB-like source by crustal or lithospheric mantle material. Geochemical characteristics of the lavas (e.g., Ba/Rb, Rb/Sr, Ba/Zr, ⁸⁷Sr/⁸⁶Sr, Sr/P) vary systematically along the fault zone from east to west, consistent with a decrease in the degree of melting from east to west or a change in the nature of the source composition itself. Thus, the difference in incompatible elements and Sr–Nd isotopic ratios seems to result from small-scale mantle heterogeneity in a post-collisional tectonic environment.     

Chromium speciation and existing natural attenuation conditions in lagoonal and pond sediments in the former chemical plant of Porto-Romano (Albania)

Near the outskirts of the Albanian port of Durres on the Adriatic Coast, at a place called Porto Romano, an old chemical complex has been producing chromate salts for a period of ∼20 years (1972–1993). As a result large quantities of chromite ore processing residue (COPR) waste were released mainly as suspended particles and/or dissolved species in effluents, which settled in a decantation pond area, 200 × 250 m in size, east of the industrial plant. Unfortunately, pollutants were spread out with time. Knowing that chromium mobility and toxicity in natural settings is species dependent, the species characterization has been carried out in different sampling media (pond sediments, lagoonal sediments and water samples). Five pond profiles were sampled within the decantation area up to a depth of ∼1 m, till the underlying Quaternary lagoonal silty-clays were reached. Total Cr content is highly variable with values between 1,130 and 24,409 mg/kg which is clearly higher than the defined local background values for lagoonal silty-clays (198 mg/kg of Cr). Leaching of Cr(VI) especially occurs in the pond sediments, which are low in OC, CEC and clay content, under acidic and neutral pH conditions (e.g. up to ∼2,230 mg/kg Cr(VI) leached from a sample containing a total concentration of Cr 12,200 mg/kg). Moreover, leaching of the Cr(III) occurs only under strictly acidic conditions (maximum 1,144 mg/kg leached from a sample containing a total Cr-concentration of 17,608 mg/kg). In this study also a number of natural attenuation conditions (i.e. reaction with lagoonal clays rich in organic matter and iron as well as isomorphous substitution) have been recognized.