Kharchenko, V.O.; Kharchenko, D.O.; Wu, X.; Wen, B.; Wu, L.; Zhang, W.
(Металлофизика и новейшие технологии, 2016)
We study structural, electronic, and energy properties of pure zirconium with isolated vacancies and their clusters. We discuss the lattice constant change in pure zirconium with different concentrations of isolated vacancy ...