REST-Rossendorf expert system for surface and sorption thermodynamics

This paper presents a digitized version of a thermodynamic sorption database, implemented as a relational database with MS Access. It is mineral-specific and can therefore be used for additive models of complex solid phases such as rocks or soils. An integrated user interface helps users to access selected mineral and sorption data, to extract internally consistent data sets for sorption modeling, and to export them in formats suitable for other modeling software. Data records comprise mineral properties, specific surface area values, surface binding sites' characteristics, sorption ligand information, and surface complexation reactions. An extensive bibliography is included, providing links not only to the above listed data, but also to background information concerning surface complexation model theories, evidence for surface species, and sorption experimental techniques.     

Modeling in situ ozonation for the remediation of nonvolatile PAH-contaminated unsaturated soils

Mathematical models were developed to investigate the characteristics of gaseous ozone transport under various soil conditions and the feasibility of in situ ozone venting for the remediation of unsaturated soils contaminated with phenanthrene. On the basis of assumptions for the mass transfer and reactions of ozone, three approaches were considered: equilibrium, kinetic, and lump models. Water-saturation-dependent reactions of gaseous ozone with soil organic matter (SOM) and phenanthrene were employed. The models were solved numerically by using the finite-difference method, and the model parameters were determined by using the experimental data of Hsu [The use of gaseous ozone to remediate the organic contaminants in the unsaturated soils, PhD Thesis, Michigan State Univ., East Lansing, MI, 1995]. The transport of gas-phase ozone is significantly retarded by ozone consumption due to reactions with SOM and phenanthrene, in addition to dissolution. An operation time of 156 h was required to completely remove phenanthrene in a 5-m natural soil column. In actual situations, however, the operation time is likely to be longer than the ideal time because of unknown factors including heterogeneity of the porous medium and the distribution of SOM and contaminant. The ozone transport front length was found to be very limited (< 1 m). The sensitivity analysis indicated that SOM is the single most important factor affecting in situ ozonation for the remediation of unsaturated soil contaminated with phenanthrene. Models were found to be insensitive to the reaction mechanisms of phenathrene with either gas-phase ozone or dissolved ozone. More study is required to quantify the effect of OH* formation on the removal of contaminant and on ozone transport in the subsurface.     

Reactive transport modeling of processes controlling the distribution and natural attenuation of phenolic compounds in a deep sandstone aquifer

Reactive solute transport modeling was utilized to evaluate the potential for natural attenuation of a contaminant plume containing phenolic compounds at a chemical producer in the West Midlands, UK. The reactive transport simulations consider microbially mediated biodegradation of the phenolic compounds (phenols, cresols, and xylenols) by multiple electron acceptors. Inorganic reactions including hydrolysis, aqueous complexation, dissolution of primary minerals, formation of secondary mineral phases, and ion exchange are considered. One-dimensional (1D) and three-dimensional (3D) simulations were conducted. Mass balance calculations indicate that biodegradation in the saturated zone has degraded approximately 1-5% of the organic contaminant plume over a time period of 47 years. Simulations indicate that denitrification is the most significant degradation process, accounting for approximately 50% of the organic contaminant removal, followed by sulfate reduction and fermentation reactions, each contributing 15-20%. Aerobic respiration accounts for less than 10% of the observed contaminant removal in the saturated zone. Although concentrations of Fe(III) and Mn(IV) mineral phases are high in the aquifer sediment, reductive dissolution is limited, producing only 5% of the observed mass loss. Mass balance calculations suggest that no more than 20-25% of the observed total inorganic carbon (TIC) was generated from biodegradation reactions in the saturated zone. Simulations indicate that aerobic biodegradation in the unsaturated zone, before the contaminant entered the aquifer, may have produced the majority of the TIC observed in the plume. Because long-term degradation is limited to processes within the saturated zone, use of observed TIC concentrations to predict the future natural attenuation may overestimate contaminant degradation by a factor of 4-5.     

Extrinsic modeling and simulation of helio-photovoltaic system: a case of single diode model

Simulation of helio-photovoltaic system is continuously undergoing revolution through diverse parameter modifications which closely mimic the experimental data. In retrospect, the current work has presented a nonlinear modification of equivalent circuit parameters and simulated the same for different semiconductors (crystalline and thin films); furthermore, established a mathematical relation between the coefficients of solar irradiance and module temperature (SIMT); moreover, investigated the influence of SIMT on the model parameters. The simulation upshot reveals that increment in solar irradiance (SI) intensifies the output current whereas an increase in module temperature (MT) diminishes the output voltage; the SIMT coefficients developed validated well with the manufacturers data; the influence of SI was evident on the photon current, diode current, and shunt resistance whereas the effect of MT was pronounced on the diode current, ideality factor, and shunt resistance. Thus, the provision made by this work is essential for advanced design and simulation of helio-photovoltaic systems.     

钢铁企业循环经济影响因素及作用路径研究

基于企业实力、环境管制、公众参与及绿色竞争等理论,提出了钢铁企业循环经济影响因素及作用路径研究模型,并采用偏最小二乘路径分析法,以我国54家钢铁企业2013年数据为例展开实证研究。结果表明:企业特征因素、市场竞争因素、政府因素对钢铁企业循环经济发展水平有直接影响,且影响效应依次递减;公众因素对循环经济发展水平有间接影响,且影响效应较低。同时,验证了此方法的科学性与适用性。     

大气边界层中起尘、降尘过程的模拟实验的相似性原则

风洞模拟实验是研究起、降尘过程最有效的手段。前人只研究了低湍流度气流中,平坦表面的实际起尘过程。作者提出一组扩展的相似性原则,用于模拟大气边界层湍流及复杂地形对趋、降尘过程的影响及防尘风障在此条件下的减尘效率,并得到一系列有意义的结果。      

Simulation and application of a disaster spread model in Chemical Disaster Network

In the research field of chemical safety, the computer-aided simulation for occurrence and process of disasters has become a major trend in current research, in which the establishment of evolution system for chemical multi disasters is the key point. In the paper, the study lays emphasis on the simulation and application of a spread model for chemical multi disasters. After establishing a disaster network, we defined microcosmic elements of spread model specifically. Combined with guideline of chemical disaster (e.g. guideline of heat flux for damages or injure, guideline of evaluation for buildings based explosion and overpressure, and guideline of evaluation for human exposure to toxic gases), the weight of impact can be computed using new comprehensive algorithms. Simultaneously, the paper also uses an approach on simulating multiple failure events to describe random factors of triggering disasters. At last, the experimental case of alkyl aluminum leakage in a polypropylene plant shows the result of simulation with table of 5 major series of disasters and distribution diagram of nodes (disasters) in disaster network. This proves the validity and practicability of the simulation system in the establishment and feedback of contingency plan of large-scale petrochemical enterprises.     

Hydrodynamic and ecological assessment of nearshore restoration: A modeling study

Along the Pacific Northwest coast, much of the estuarine habitat has been lost over the last century to agricultural land use, residential and commercial development, and transportation corridors. As a result, many of the ecological processes and functions have been disrupted. To protect and improve these coastal habitats that are vital to aquatic species, many projects are currently underway to restore estuarine and coastal ecosystems through dike breaches, setbacks, and removals. Understanding site-specific information on physical processes is critical for improving the success of such restoration actions. In this study, a three-dimensional hydrodynamic model was developed to simulate estuarine processes in the Stillaguamish River estuary, where restoration of a 160-acre parcel through dike setback has been proposed. The model was calibrated to observed tide, current, and salinity data for existing conditions and applied to simulate the hydrodynamic responses to two restoration alternatives. Model results were then combined with biophysical data to predict habitat responses within the restoration footprint. Results showed that the proposed dike removal would result in desired tidal flushing and conditions that would support four habitat types on the restoration footprint. At the estuary scale, restoration would substantially increase the proportion of area flushed with freshwater (<5 ppt) at flood tide. Potential implications of predicted changes in salinity and flow dynamics are discussed relative to the distribution of tidal marsh habitat.     

Passive and active adaptive management: approaches and an example

Adaptive management is a framework for resource conservation that promotes iterative learning-based decision making. Yet there remains considerable confusion about what adaptive management entails, and how to actually make resource decisions adaptively. A key but somewhat ambiguous distinction in adaptive management is between active and passive forms of adaptive decision making. The objective of this paper is to illustrate some approaches to active and passive adaptive management with a simple example involving the drawdown of water impoundments on a wildlife refuge. The approaches are illustrated for the drawdown example, and contrasted in terms of objectives, costs, and potential learning rates. Some key challenges to the actual practice of AM are discussed, and tradeoffs between implementation costs and long-term benefits are highlighted.