Journal of the Physical Society of Japan · 1971 · 21 citations · 20 references
Natural SciencesPhysicsCondensed Matter PhysicsCrystal StructureSolid State PhysicsAb Initio MethodsCrystallographyElectronic Band StructureMetalsPotential Energy SurfacesSurface PhysicsAb Initio Potential Energy SurfacesFermi SurfaceRadial DistortionRadial Distortion CorrectionStatistical Potentials
Radial distortions of the Fermi surface are evaluated for K and Rb by APW method. The Hartree-Fock-Slater potential, the Wigner-Seitz potential, and the Hedin potential, which were used to evaluate the radial distortion of the Fermi surface of K and Rb in a previous paper, are now modified to be l -dependent in order to obtain a good agreement between the calculated and the observed Fermi surface. It is found that very slight modification of the potential is sufficient to have an excellent agreement.
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A Simplification of the Hartree-Fock Method
J. C. Slater · Physical Review · 1951 · 4.5K citations
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