Kavli Affiliate: Kristin A. Persson | First 5 Authors: Matthew J. McDermott, Brennan C. McBride, Corlyn Regier, Gia Thinh Tran, Yu Chen | Summary: Synthesis is a major challenge in the discovery of new inorganic materials. Currently, there is limited theoretical guidance for identifying optimal solid-state synthesis procedures. We introduce two selectivity metrics, primary and […]
Continue.. Assessing Thermodynamic Selectivity of Solid-State Reactions for the Predictive Synthesis of Inorganic Materials