Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
10653622 | Solid State Communications | 2005 | 6 Pages |
Abstract
The structural stability of CeAg has been studied by self-consistent full-potential linearized augmented plane wave method (FP_LAPW) based on the density functional theory (DFT). The result shows that the low-temperature phase of CeAg is not a simple tetragonal structure. The degenerate d states at the Fermi level are split because of atomic shifts, which result in the cubic-to-tetragonal transition.
Related Topics
Physical Sciences and Engineering
Materials Science
Materials Science (General)
Authors
Y.S. Zhang, K.L. Yao, Z.L. Liu,