Publication Date:
2014-04-02
Description:
Author(s): T. Jarlborg, B. Barbiellini, C. Lane, Yung Jui Wang, R. S. Markiewicz, Zhi Liu, Zahid Hussain, and A. Bansil The electronic structures of supercells of CeO2−δ have been calculated within the density functional theory (DFT). The equilibrium properties such as lattice constants, bulk moduli, and magnetic moments are well reproduced by the generalized gradient approximation (GGA). Electronic excitations are s... [Phys. Rev. B 89, 165101] Published Tue Apr 01, 2014
Keywords:
Electronic structure and strongly correlated systems
Print ISSN:
1098-0121
Electronic ISSN:
1095-3795
Topics:
Physics