Understanding the Clean Interface Between Covalent Si and Ionic Al2O3Hongjun XiangJuarez L. F. da SilvaHoward M. BranzSu-Huai WeiAPS March Meeting Abstracts
Thus, it can be concluded that there are the occurrences of the strong hybridization between Al p and Ti d in the r LPS, and the pseudogap near the Femi level in its total DOS, showing the existence of the covalent bonds in the r one. As described in Ref. [25], the Fermi energy ...
JEMMIS E D,GIJU K T,LESZCZYNSKI J.Ionic to covalent bonding: a density functional theory study of linear and bent X2Y3 monomers (X = B, Al, Ga, In Y = O, S, Se). Electronic Journal of Theoretical Chemistry . 1997JEMMIS E D,GIJU K T,LESZCZYNSKI J.Ionic to covalent bonding...
JEMMIS E D,GIJU K T,LESZCZYNSKI J.Ionic to covalent bonding: a density functional theory study of linear and bent X2Y3 monomers (X = B, Al, Ga, In Y = O, S, Se). Electronic Journal of Theoretical Chemistry . 1997JEMMIS E D,GIJU K T,LESZCZYNSKI J.Ionic to covalent bonding...
ELF values of T phases were larger than that of MgZn2 phase, revealing that T phase presented the characteristics of partial covalent bond. As showed in Figure 3, the Al–Zn, Mg–Mg bonding contributed to the high electron localization for Al26Zn72Mg64–C and Al26Zn72Mg64–B. As for ...