1. Thermodynamic investigation of transition metal oxides via CALPHAD and first-principles methods Open Access Author: Zhang, Lei Title: Thermodynamic investigation of transition metal oxides via CALPHAD and first-principles methods Graduate Program: Materials Science and Engineering Keywords: CALPHADtransition metal oxidesphase stabilityfirst-principlesdefect File: Download Lei-MSThesis-v6.pdf Committee Members: Zi Kui Liu, Thesis Advisor/Co-Advisor