A Linear Tetrahedron Method of Compton Profiles for Cubic Crystals
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概要
- 論文の詳細を見る
A linear tetrahedron method is introduced to calculate directional Compton profiles of valence electrons for cubic crystals. For the two dimensional integration a linear interpolation of both the energy and momentum density is used within each tetrahedron. They cover one 48th of the BZ (Brillouin zone) of each reciprocal vector. The program is linked to the output of FLAPW (full potential linearized augmented-plane-wave) method coded in WIEN97. As an example results for Al are described.
- 社団法人日本物理学会の論文
- 2002-03-15
著者
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WAKOH Shinya
University of Library and In formation Science
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TOKII Maki
University of Library and In formation Science
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Tokii Maki
University Of Library And Information Science
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Wakoh Shinya
University For Library And Information Science
関連論文
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- Theoretical Momentum Distributions in Nb_3O_3
- Energy Band of Nb-Mo Alloy and Its Dependence on Alloy Potentials
- An Effective Potential of Metallic Vanadium and Chromium
- Electronic Structure of 3d-and 4d-Transition Metal Alloys
- Magnetic Compton Profile and Spin Polarized Positron Annihilation Radiation in Hcp Cobalt
- A Linear Tetrahedron Method of Compton Profiles for Cubic Crystals
- Two-Dimensional Electron Momentum Densities in Nb-Mo Alloys
- Compton Profile of Nb-Mo Alloys
- Electron Correlation Effect on the Directional Compton Profiles of Mg
- Two-Dimensional Angular Correlation Distributions of Positron Annihilation Radiation in Vanadium and Chromium