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A high-fidelity multi-step global kinetic Selective Catalytic Reduction (SCR) model which can predict SCR performance in engine exhaust systems is desirable for optimizing the SCR system, designing on-vehicle control systems and on-board diagnostic (OBD) functions. In this study, a Cu-zeolite SCR catalyst in the exhaust of a 2010 Cummins 6.7L ISB diesel engine was experimentally studied under both steady-state and transient conditions. Steady-state engine tests spanned SCR inlet temperatures from 250 to 400°C with a constant space velocity of 60 khr-1. A 1-D Cu-zeolite model originally developed from reactor data was improved and calibrated to the steady-state engine experimental data. The calibrated model is capable of predicting NO/NO₂ reduction, NH₃ slip, and NH₃ storage associated phenomena.

In order to further characterize and optimize the performance of Selective Catalytic Reduction (SCR) aftertreatment systems used on heavy-duty diesel engines, an accurately calibrated high-fidelity multi-step global kinetic SCR model and a reduced order estimator for on-board diagnostic (OBD) and control are desirable. In this study, a Cu-zeolite SCR catalyst from a 2010 Cummins ISB engine was experimentally studied in a flow reactor using carefully designed protocols. A 2-site SCR model describing mass transfer and the SCR chemical reaction mechanisms is described in the paper. The model was calibrated to the reactor test data sets collected under temperatures from 200 to 425 °C and SCR space velocities of 60000, 90000, and 120000 hr-1. The model parameters were calibrated using an optimization code to minimize the error between measured and simulated NO, NO₂, N₂O, and NH₃ gas concentration time histories.