Kavli Affiliate: Kristin A. Persson | First 5 Authors: Rachel Woods-Robinson, Matthew K. Horton, Kristin A. Persson, , | Summary: Conventionally, high-throughput computational materials searches start from an input set of bulk compounds extracted from material databases, and this set is screened for candidate materials for specific applications. In contrast, many functional materials, and especially […]
Continue.. A method to computationally screen for tunable properties of crystalline alloys