Geochemical and Biogeochemical Reaction Modeling
Geochemical and Biogeochemical Reaction Modeling

Author: Craig M. Bethke

Publisher: Cambridge University Press

Published: 2010-12-09

Total Pages: 564

ISBN-13: 1139468324

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This book provides a comprehensive overview of reaction processes in the Earth's crust and on its surface, both in the laboratory and in the field. A clear exposition of the underlying equations and calculation techniques is balanced by a large number of fully worked examples. The book uses The Geochemist's Workbench® modeling software, developed by the author and already installed at over 1000 universities and research facilities worldwide. Since publication of the first edition, the field of reaction modeling has continued to grow and find increasingly broad application. In particular, the description of microbial activity, surface chemistry, and redox chemistry within reaction models has become broader and more rigorous. These areas are covered in detail in this new edition, which was originally published in 2007. This text is written for graduate students and academic researchers in the fields of geochemistry, environmental engineering, contaminant hydrology, geomicrobiology, and numerical modeling.

Groundwater Reactive Transport Models
Groundwater Reactive Transport Models

Author: Gour-Tsyh (George) Yeh

Publisher:

Published: 2012-03-15

Total Pages: 256

ISBN-13: 9781608055258

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Ground water reactive transport models are useful to assess and quantify contaminant precipitation, absorption and migration in subsurface media. Many ground water reactive transport models available today are characterized by varying complexities, strengths, and weaknesses. Selecting accurate, efficient models can be a challenging task. This book addresses the needs, issues and challenges relevant to selecting a ground water reactive transport model to evaluate natural attenuation and alternative remediation schemes. It should serve as a handy guide for water resource managers seeking to achieve economically feasible results.

Reactive Transport in Porous Media
Reactive Transport in Porous Media

Author: Peter C. Lichtner

Publisher: Walter de Gruyter GmbH & Co KG

Published: 2018-12-17

Total Pages: 452

ISBN-13: 1501509799

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Volume 34 of Reviews in Mineralogy focuses on methods to describe the extent and consequences of reactive flow and transport in natural subsurface systems. Since the field of reactive transport within the Earth Sciences is a highly multidisciplinary area of research, including geochemistry, geology, physics, chemistry, hydrology, and engineering, this book is an attempt to some extent bridge the gap between these different disciplines. This volume contains the contributions presented at a short course held in Golden, Colorado, October 25-27, 1996 in conjunction with the Mineralogical Society of America's (MSA) Annual Meeting with the Geological Society of America in Denver, Colorado.

Groundwater Geochemistry
Groundwater Geochemistry

Author: Broder J. Merkel

Publisher: Springer Science & Business Media

Published: 2008-05-30

Total Pages: 230

ISBN-13: 3540746684

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To understand hydrochemistry and to analyze natural as well as man-made impacts on aquatic systems, hydrogeochemical models have been used since the 1960’s and more frequently in recent times. Numerical groundwater flow, transport, and geochemical models are important tools besides classical deterministic and analytical approaches. Solving complex linear or non-linear systems of equations, commonly with hundreds of unknown parameters, is a routine task for a PC. Modeling hydrogeochemical processes requires a detailed and accurate water analysis, as well as thermodynamic and kinetic data as input. Thermodynamic data, such as complex formation constants and solubility-products, are often provided as databases within the respective programs. However, the description of surface-controlled reactions (sorption, cation exchange, surface complexation) and kinetically controlled reactions requires additional input data. Unlike groundwater flow and transport models, thermodynamic models, in principal, do not need any calibration. However, considering surface-controlled or kinetically controlled reaction models might be subject to calibration. Typical problems for the application of geochemical models are: • speciation • determination of saturation indices • adjustment of equilibria/disequilibria for minerals or gases • mixing of different waters • modeling the effects of temperature • stoichiometric reactions (e.g. titration) • reactions with solids, fluids, and gaseous phases (in open and closed systems) • sorption (cation exchange, surface complexation) • inverse modeling • kinetically controlled reactions • reactive transport Hydrogeochemical models depend on the quality of the chemical analysis, the boundary conditions presumed by the program, theoretical concepts (e.g.

Reactive Flow Modeling of Hydrothermal Systems
Reactive Flow Modeling of Hydrothermal Systems

Author: Michael Kühn

Publisher: Springer Science & Business Media

Published: 2004-01-22

Total Pages: 284

ISBN-13: 9783540203384

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1. General Significance of Geochemical Models of Hydrothermal Systems,- 2. Concepts, Classification and Chemistry of Geothermal Systems,- 3.Theory of Chemical Modeling,- 4. Specific Features of Coupled Fluid Flow and Chemical Reaction,- 5. Fossil Hydrothermal Systems,- 6. Recent Hydrothermal Systems,- 7. Reservoir Management.

Reactive Transport Modeling
Reactive Transport Modeling

Author: Yitian Xiao

Publisher: John Wiley & Sons

Published: 2018-03-14

Total Pages: 689

ISBN-13: 1119060028

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Teaches the application of Reactive Transport Modeling (RTM) for subsurface systems in order to expedite the understanding of the behavior of complex geological systems This book lays out the basic principles and approaches of Reactive Transport Modeling (RTM) for surface and subsurface environments, presenting specific workflows and applications. The techniques discussed are being increasingly commonly used in a wide range of research fields, and the information provided covers fundamental theory, practical issues in running reactive transport models, and how to apply techniques in specific areas. The need for RTM in engineered facilities, such as nuclear waste repositories or CO2 storage sites, is ever increasing, because the prediction of the future evolution of these systems has become a legal obligation. With increasing recognition of the power of these approaches, and their widening adoption, comes responsibility to ensure appropriate application of available tools. This book aims to provide the requisite understanding of key aspects of RTM, and in doing so help identify and thus avoid potential pitfalls. Reactive Transport Modeling covers: the application of RTM for CO2 sequestration and geothermal energy development; reservoir quality prediction; modeling diagenesis; modeling geochemical processes in oil & gas production; modeling gas hydrate production; reactive transport in fractured and porous media; reactive transport studies for nuclear waste disposal; reactive flow modeling in hydrothermal systems; and modeling biogeochemical processes. Key features include: A comprehensive reference for scientists and practitioners entering the area of reactive transport modeling (RTM) Presented by internationally known experts in the field Covers fundamental theory, practical issues in running reactive transport models, and hands-on examples for applying techniques in specific areas Teaches readers to appreciate the power of RTM and to stimulate usage and application Reactive Transport Modeling is written for graduate students and researchers in academia, government laboratories, and industry who are interested in applying reactive transport modeling to the topic of their research. The book will also appeal to geochemists, hydrogeologists, geophysicists, earth scientists, environmental engineers, and environmental chemists.

Modeling Groundwater Flow and Contaminant Transport
Modeling Groundwater Flow and Contaminant Transport

Author: Jacob Bear

Publisher: Springer Science & Business Media

Published: 2010-01-18

Total Pages: 851

ISBN-13: 1402066821

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In many parts of the world, groundwater resources are under increasing threat from growing demands, wasteful use, and contamination. To face the challenge, good planning and management practices are needed. A key to the management of groundwater is the ability to model the movement of fluids and contaminants in the subsurface. The purpose of this book is to construct conceptual and mathematical models that can provide the information required for making decisions associated with the management of groundwater resources, and the remediation of contaminated aquifers. The basic approach of this book is to accurately describe the underlying physics of groundwater flow and solute transport in heterogeneous porous media, starting at the microscopic level, and to rigorously derive their mathematical representation at the macroscopic levels. The well-posed, macroscopic mathematical models are formulated for saturated, single phase flow, as well as for unsaturated and multiphase flow, and for the transport of single and multiple chemical species. Numerical models are presented and computer codes are reviewed, as tools for solving the models. The problem of seawater intrusion into coastal aquifers is examined and modeled. The issues of uncertainty in model input data and output are addressed. The book concludes with a chapter on the management of groundwater resources. Although one of the main objectives of this book is to construct mathematical models, the amount of mathematics required is kept minimal.

Applied Contaminant Transport Modeling
Applied Contaminant Transport Modeling

Author: Chunmiao Zheng

Publisher: Wiley

Published: 1995-08-07

Total Pages: 0

ISBN-13: 9780471285366

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Applied Contaminant Transport Modeling Theory and Practice Chunmiao Zheng and Gordon D. Bennett The design of remedial systems for groundwater contamination requires a thorough understanding of how various interacting processes — advection, dispersion, and chemical reactions — influence the movement and fate of contaminants. Solute transport simulation provides an ideal vehicle to synthesize these controlling processes, evaluate their interactions, and test the effectiveness of remedial measures. Applied Contaminant Transport Modeling is the first complete resource designed to provide clear coverage of the basic principles of solute transport simulation — including the theory behind the most common numerical techniques for solving transport equations, and step-by-step guidance on the development and use of field-scale models. Written by two experts with extensive practical experience in the field, Applied Contaminant Transport Modeling clearly explains: Factors controlling the transport and fate of solutes in the subsurface —g including advective and dispersive transport and chemical reaction — and the equations governing these processes Development of mathematical models of solute transport regimes and representative analytical solutions to the transport equation Particle tracking as a practical tool for solving many types of field problems Development of Eulerian-Lagrangian methods for solving advection-dispersion-reaction equations Step-by-step development and application of solute transport models — emphasizing problem formulation, model setup, parameter selection, calibration, and sensitivity analysis Sources of uncertainty in transport simulation, and methods of evaluating and managing uncertainty Applied Contaminant Transport Modeling presents detailed case histories illustrating how hydrologists, geologists, chemists, and environmental engineers apply transport models in real-life situations, including landfills, hazardous waste sites, and contaminated aquifers. An optional diskette designed to accompany the text provides software to help the reader explore the concepts and techniques presented in the text and gain hands-on experience in transport simulation. Driven by growing concern over groundwater quality and the rapid dissemination of computer technology, solute transport simulation has become an essential means of evaluating and solving groundwater contamination and remediation problems. Applied Contaminant Transport Modeling provides you with the tools to master this significant field of study.

Applied Groundwater Modeling
Applied Groundwater Modeling

Author: Mary P. Anderson

Publisher: Academic Press

Published: 2015-08-13

Total Pages: 632

ISBN-13: 0080916384

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This second edition is extensively revised throughout with expanded discussion of modeling fundamentals and coverage of advances in model calibration and uncertainty analysis that are revolutionizing the science of groundwater modeling. The text is intended for undergraduate and graduate level courses in applied groundwater modeling and as a comprehensive reference for environmental consultants and scientists/engineers in industry and governmental agencies. - Explains how to formulate a conceptual model of a groundwater system and translate it into a numerical model - Demonstrates how modeling concepts, including boundary conditions, are implemented in two groundwater flow codes-- MODFLOW (for finite differences) and FEFLOW (for finite elements) - Discusses particle tracking methods and codes for flowpath analysis and advective transport of contaminants - Summarizes parameter estimation and uncertainty analysis approaches using the code PEST to illustrate how concepts are implemented - Discusses modeling ethics and preparation of the modeling report - Includes Boxes that amplify and supplement topics covered in the text - Each chapter presents lists of common modeling errors and problem sets that illustrate concepts