Electronic structure and excitations in oxygen deficient CeO_(2-δ) from DFT calculations

著录项

• 来源
  《Physical review》 |2014年第16期|165101.1-165101.7|共7页
• 作者

  T. Jarlborg; B. Barbiellini; C. Lane; Yung Jui Wang; R. S. Markiewicz; Zhi Liu; Zahid Hussain; A. Bansil;

  展开▼
• 作者单位

  DPMC, University of Geneva, 24 Quai Ernest-Ansermet,CH-1211 Geneva 4, Switzerland;

  Department of Physics, Northeastern University, Boston, Massachusetts 02115, USA;

  Department of Physics, Northeastern University, Boston, Massachusetts 02115, USA;

  Department of Physics, Northeastern University, Boston, Massachusetts 02115, USA,Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA;

  Department of Physics, Northeastern University, Boston, Massachusetts 02115, USA;

  Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA;

  Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA;

  Department of Physics, Northeastern University, Boston, Massachusetts 02115, USA;

  展开▼
• 收录信息
• 原文格式 PDF
• 正文语种 eng
• 中图分类
• 关键词

  narrow-band systems; intermediate-valence solids; density functional theory, local density approximation, gradient and other corrections; excited states: methodology; photoemission and photoelectron spectra;

  机译：窄带系统;中价固体;密度泛函理论;局部密度近似;梯度和其他校正;激发态：方法论光发射和光电子能谱;