First principles LDA+U and GGA+U study of HfO2: Dependence on the effective U parameter.

Autor: ÇİFTCİ, Yasemin Ö.1 yasemin@gazi.edu.tr, ERGÜN, A. H.1, ÇOLAKOĞLU, K.1, DELİGÖZ, E.2
Zdroj: Gazi University Journal of Science. Jan2014, Vol. 27 Issue 1, p627-636. 10p.
Databáze: Academic Search Ultimate