Band Structure of NbSe_3

スポンサーリンク

概要

• 論文の詳細を見る

• The electronic band structure of NbSe. is calculated by the relativistic LCAO-Xa-SCF method. The electronic structure near the Fermi level is found to becrucially influenced by the presence of the two kinds of prismatic chains in theunit cell. The calculated density of states explains qualitatively the observedXPS spectrum. There are five conduction bands whose main orbital componentare dz' orbitals of Nb atoms. About 0.6 -0.7 electrons transfer from each Nbatom to Se atoms. The partial densities of state of orbital components are alsocalculated to understand the character of each band.

• 社団法人日本物理学会の論文
• 1983-02-15

著者

• Shima Nobuyuki

  Institute For Molecular Science

関連論文

• Fermi Surfaces of NbSe_3
• Band Structure of NbSe_3

スポンサーリンク