DFT + U and ab initio atomistic thermodynamics approache for mixed transitional metallic oxides: A case study of CoCu2O3 surface terminations

DFT + U and ab initio atomistic thermodynamics approache for mixed transitional metallic oxides: A case study of CoCu2O3 surface terminations

Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Materials Chemistry and Physics - Volume 201, 1 November 2017, Pages 241-250

Hantarto Widjaja, Hussein A. Miran, Mohammednoor Altarawneh, Ibukun Oluwoye, Hong Ngee Lim, Nay Ming Huang, Zhong-Tao Jiang, Bogdan Z. Dlugogorski,