id	author	title	date	pages	extension	mime	words	sentence	flesch	summary	cache	txt
6969z032s60	Bridgette J. Befort	An Integrated Molecular and Process Design and Optimization Framework for Ionic Liquid Enabled Separation of Azeotropic Hydrofluorocarbon Refrigerants	2023		.txt	text/plain	346	13	14	This data-to-design framework is an example of highly collaborative, integrated research that bridges the perspectives and tools of the experimental, molecular science and engineering, and process systems engineering communities to develop novel solutions to an ongoing chemical engineering challenge. First, we demonstrate two workflows which harness machine learning and Bayesian optimization techniques to fit cheap-to-evaluate surrogate models as replacements for computationally expensive molecular simulations, enabling rapid calibration of molecular models for HFCs.	cache/6969z032s60.txt	txt/6969z032s60.txt