Density functional theory-based ab initio molecular dynamics simulation of ionic conduction in N-/F-doped ZrO2 under epitaxial strain

Density functional theory-based ab initio molecular dynamics simulation of ionic conduction in N-/F-doped ZrO2 under epitaxial strain

Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Computational Materials Science - Volume 154, November 2018, Pages 91-96

Mayuko Oka, Hideyuki Kamisaka, Tomoteru Fukumura, Tetsuya Hasegawa,