TY - RPRT TI - A comprehensive first-principles study of the effects of the exchange-correlation functional and magnetism on defect and diffusion properties of the CoCrNi medium-entropy alloy AU - Lafferty, Christopher R. [New Mexico Institute of Mining and Technology, Socorro, NM (United States)] AU - Liaw, Peter K. [Univ. of Tennessee, Knoxville, TN (United States)] AU - Hargather, Chelsey Zacherl [New Mexico Institute of Mining and Technology, Socorro, NM (United States); Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)] (ORCID:0000000214469112) PY - 2026 DO - 10.1016/j.mtcomm.2025.114609 UR - https://www.osti.gov/biblio/3013792 ID - 3013792 ER -