4.6 Article

LDA plus DMFT approach to electronic structure of sodium metal

期刊

PHYSICAL REVIEW B
卷 100, 期 11, 页码 -

出版社

AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.100.115156

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资金

  1. CNPq [304035/2017-3]
  2. UK Research Council [EP/M50631X/1]
  3. EPSRC [EP/L000202]
  4. Office of Science and Technology through EPSRC's High End Computing Programme
  5. DFG [SPP1415]

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Based on local density approximation plus dynamical mean-field theory (LDA+DMFT) calculations, we revisit the long-standing quasiparticle band narrowing problem of sodium metal. Using an on-site Coulomb interaction U derived from angle-resolved photoemission spectroscopy mass enhancement, we can describe various properties of this weakly correlated electron system. Intrinsic self-energy corrections lead to a Landau-Fermi liquid state with many-particle coherence and dynamical spectral weight transfer relevant to electronic structure and scattering rates of alkali metals.

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