A reaction-based river/stream water quality model: Reaction network decomposition and model application

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Title:	A reaction-based river/stream water quality model: Reaction network decomposition and model application
Authors:	葉高次;Zhang, Fan;Yeh, Gour-Tsyh;Parker, Jack C.;Zhang, Hongbo;Shi, Xiaonan;Wang, Cheng;Gu, Ruochuan
Contributors:	地球科學學院應用地質研究所
Keywords:	Chemical equilibrium/kinetics;Chemical reactions;Chemical transport;Computer simulation;Conservation;Decomposition;Decomposition reactions;Differential equations;Equilibrium;Equilibrium equations;Eutrophication;Mathematical models;Numerical integration;Organic chemistry;Rivers;Rivers/streams;Robustness (mathematics);Sediment transport;Stream water;Transport;Transport equations;Water quality;Water quality models;Wildlife conservation
Date:	2012-10-01
Issue Date:	2026-04-23 14:53:26 (UTC+8)
Publisher:	Chinese Geoscience Union;Taiwan: 中華民國地球科學學會
Abstract:	摘要： This paper describes details of an automatic matrix decomposition approach for a reaction-based stream water quality model. The method yields a set of equilibrium equations, a set of kinetic-variable transport equations involving kinetic reactions only, and a set of component transport equations involving no reactions. Partial decomposition of the system of water quality constituent transport equations is performed via Gauss-Jordan column reduction of the reaction network by pivoting on equilibrium reactions to decouple equilibrium and kinetic reactions. This approach minimizes the number of partial differential advective-dispersive transport equations and enables robust numerical integration. Complete matrix decomposition by further pivoting on linearly independent kinetic reactions allows some rate equations to be formulated individually and explicitly enforces conservation of component species when component transport equations are solved. The methodology is demonstrated for a case study involving eutrophication reactions in the Des Moines River in Iowa, USA and for two hypothetical examples to illustrate the ability of the model to simulate sediment and chemical transport with both mobile and immobile water phases and with complex reaction networks involving both kinetic and equilibrium reactions. 出版者： Taiwan: 中華民國地球科學學會出版日期： 2012-10-01 出處： TAO : Terrestrial, atmospheric, and oceanic sciences, 2012-10, Vol.23 (5), p.605-620 資源來源： Chinese Electronic Periodical Services (CEPS)_2025 版權： 2012. This work is licensed under https://creativecommons.org/licenses/by/4.0/ (the “License”). Notwithstanding the ProQuest Terms and Conditions, you may use this content in accordance with the terms of the License. 識別號： ISSN: 1017-0839 識別號： ISSN: 2223-8964 識別號： ISSN: 2311-7680 識別號： EISSN: 2311-7680 識別號： DOI: 10.3319/TAO.2012.05.23.02(WMH)
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