Novel Correlation for the Solid–Liquid Mass Transfer Coefficient in Stirred Tanks Developed by Interpreting Machine Learning Models Trained on Literature Data

Abstract

Predicting the solid–liquid mass transfer coefficient (k SL) in stirred tanks is of great importance in the chemical, metallurgical, and allied process industries. While there are several correlations available in literature to predict this parameter, they are only applicable to a narrow range of variables. In this work, 1117 data points are collected from 13 research papers. First, three machine learning models are developed for the prediction of the Sherwood Number (Sh) using two approaches, viz., (a) incorporating engineered features (EFs) as inputs and (b) using independent variables as inputs. The CatBoost regressor (CatB) is found to be more accurate than the random forest regressor and artificial neural network regressor, achieving an impressive R 2 > 0.95 for test data. Next, the CatB model is interpreted by two approaches: (a) sensitivity analysis of the EFs and (b) determination of the functional form of the correlation based on CatB model’s predictions that developed using independent features. Furthermore, this novel, human-readable correlation is validated by fitting it to 816 experimental data points for the disc turbine impeller, yielding an impressive R 2 = 0.92, which is superior to the current state-of-the-art.