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    A framework for modelling the interactions between biochemical reactions and inorganic ionic reactions in aqueous systems.
    (2022) Brouckaert, Christopher John.; Lokhat, David.
    Bio‐processes interact with the aqueous environment in which they take place. Integrated bio‐process and three‐phase (aqueous–gas–solid) multiple strong and weak acid/base system models are being developed for a range of wastewater treatment applications, including anaerobic digestion, biological sulphate reduction, autotrophic denitrification, biological desulphurization and plant‐wide wastewater treatment systems. In order to model, measure and control such integrated systems, a thorough understanding of the interaction between the bio‐processes and aqueous‐phase multiple strong and weak acid/bases is required. This thesis is based on a series of five papers that were published in Water SA during 2021 and 2022. Chapter 2 (Part 1 of the series) sets out a conceptual framework and a methodology for deriving bioprocess stoichiometric equations. It also introduces the relationship between alkalinity changes in bioprocesses and the underlying reaction stoichiometry, which is a key theme of the series. Chapter 3 (part 2 of the series) presents the stoichiometric equations of the major biological processes and shows how their structure can be analysed to provide insight into how bioprocesses interact with the aqueous environment. Such insight is essential for confident, effective and reliable use of model development protocols and algorithms. Where aqueous ionic chemistry is combined with biological chemistry in a bioprocess model, it is advantageous to deal with the very fast ionic reactions in an equilibrium sub‐model. Chapter 4 (part 5 of the series) presents details of how of such an equilibrium speciation sub‐model can be implemented, based on well‐known open‐source aqueous chemistry models. Specific characteristics of the speciation calculations which can be exploited to reduce the computational burden are highlighted. The approach is illustrated using the ionic equilibrium sub‐model of a plant‐wide wastewater treatment model as an example. Provided that the correct measurements are made that can quantify the material content of the bioprocess products (outputs), the material content of the bioprocess reactants (inputs) can be determined from the bioprocess products via stoichiometry. The links between the modelling and measurement frameworks, which use summary measures such as chemical oxygen demand (COD) and alkalinity, are described in parts 3 and 4 of the series, which are included as appendices to the thesis. An additional paper, presenting case study on modelling an auto‐thermal aerobic bio‐reactor, is included as a third appendix, as it demonstrates the application of some of the principles developed in the series of papers.
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    Developing integrated climate change adaptation strategies using the water-energy-food nexus approach: a case study of the Buffalo River catchment, South Africa.
    (2023) Dlamini, Nosipho.; Senzanje, Aidan.; Mabhaudhi, Tafadzwanashe.
    South Africa’s climate has high spatial and temporal variability. Literature on historical rainfall patterns shows substantial declines in rainfall across the country, except in south-western South Africa, which displays increasing trends. Under the Representative Concentration Pathways (RCPs) 4.5 and 8.5 scenarios, statistically downscaled rainfall projections show different patterns across South Africa throughout the 21st century. Literature indicates that this uncertainty will majorly impact South Africa’s surface water availability as its main input variable is rainfall; hence, all possible outcomes need to be planned for. Planning should include the energy and food production sectors as they primarily depend on the water sector. The Buffalo River catchment, situated in the northern parts of KwaZulu-Natal, South Africa, is a high rainfall receiving area, with a mean annual precipitation of 802 mm. Despite its abundant rainfall, the catchment has had its fair share of droughts, significantly impacting livelihoods and socio-economic activities. Recent reports indicate that the Buffalo River catchment’s surface water storage facilities are insufficient to meet the population’s demands by 2050. A detailed water resources assessment is required to confirm and quantify the possible alterations that climate change could cause to the catchment’s hydrology before any actions can be taken, especially regarding increasing the water storage capacity of the catchment. As such, this study aims to investigate and assess the impacts of climate change on the Buffalo River catchment’s surface water availability and reliability of water resources in meeting projected water demands, with a specific focus on agricultural and energy generation water demands. Furthermore, the study aims to develop integrated water resources adaptation strategies to increase water, energy and food security within the catchment. Due to its transdisciplinary nature, the Water-Energy-Food (WEF) nexus methodology was used as an analytical tool to carry out the research’s objectives. The study was based on the null hypotheses of climate change not varying surface water availability and reliability, and that the optimized CC water management strategies will not yield any improvements in merging potential gaps between water supply and demands. Study findings indicate that the Buffalo River catchment is anticipated to receive increases in precipitation magnitude and fluctuations throughout the 21st century. However, the increases in surface water availability that result from the anticipated rainfall increases are insufficient and unreliable to meet the rise in demands for water within the catchment, more so the irrigation demands. Through investigating the catchment’s already-existing proposed climate change policy interventions for water resources management, the study found that they were centred around boosting domestic water provisions whilst only meeting <3% of projected demands by the energy and agricultural sector. As such, by optimizing these policy plans using the WEF nexus’ Climate, Land-Use and Water Strategies (CLEWS) framework’s analytical tools, integrated climate change adaptation strategies were formulated, which were modelled to significantly improve the water storage capacity of the catchment, as well as water allocations and distribution among water users. The study concluded that the Buffalo River catchment’s surface water availability is expected to increase under climate change, however, current water storage capacity is not reliable to meet water demands throughout the 21st century. Lastly, the study also concluded that the catchment does possess immense potential for improved surface water availability to merge the gap between its water supplies and demands. Thus, the null hypotheses stipulated in this research are rejected. For discussions, policymaking and general research related to these improvements in water resources management in the Buffalo River catchment, the climate change adaptation strategies established in this research are recommended. Also, based on model evaluation statistics, the WEF nexus was successful in examining the interrelations among WEF resources, and is recommended for future studies to examine long-term integrated demand-supply strategies for WEF sectors.