Insight into the relationship between similarity and the degree of equilibrium of contaminant release curves through numerical simulations

Abstract

The assumption of local equilibrium, especially in test standards for assessing the leaching of hazardous substances from materials, is crucial for the use of test results and the robustness of testing. However, previous studies of contact time conditions in percolation test standard have evaluated equilibrium and robustness separately. Therefore, this study tests the assumption of local equilibrium in the up-flow percolation test, standardized as ISO 21268-3 in 2019, and discusses the relationship between the similarity of test results and degree of equilibrium. Thus, we conducted approximately 6000 numerical simulations in total with varying leaching parameters to determine breakthrough curves (BTCs) for the substances investigated by the test standard. The results showed that the two BTCs for the longest and shortest contact time conditions within the standard test were identical over a wide range of parameters, supporting the robustness of the standard test. Interestingly, identical BTCs occur in equilibrium or near-equilibrium and nonequilibrium leaching. This finding indicates the need to reconsider the conventional interpretation that equilibrium is reached when test results with different contact time conditions appear identical and encourages efforts to develop procedures to verify equilibrium leaching.