Disposal of nuclear waste in host rock formations featuring high-saline solutions - Implementation of a thermodynamic reference database (THEREDA)

It is the objective of this paper to explain how THEREDA is designed from a data management point-of-view, both conceptionally and technically. Data tables and mutual dependencies are described that allow managing administration of data for aqueous solution, solids, solid solutions, and surfaces. Moreover, quality assurance, traceability, consistency, and efficient, long-term maintenance are major topics shaping the database structure. Finally, robust and flexible human interfaces (to editors as well as end-users) are implemented. This paper is not aimed at giving an account of the model definitions, system selections, evaluation schemes, and thermodynamic data themselves stored in THEREDA, which represent the actual scientific work done by many more scientists within the project. However, this methodological guide to THEREDA has its own merits as it helps to bring thermodynamic data to work. Its specific implementation may serve as a useful example for similar projects going far beyond waste disposal.