Journal of Physics F Metal Physics · 1979 · 42 citations · 21 references
Natural SciencesMaterials SciencePhysicsMaterials PhysicsMetallic MaterialsSolid State PhysicsAb Initio MethodsAlloysElectric PotentialElectron-phonon InteractionsMetal MaterialsMetalsDispersion RelationsEnergy Dispersion RelationMaterial Dispersion ModelingNoble Metal AlloysPhonon CalculationsPhonon Dispersion RelationsPhonon-phonon Interactions
The resonant model potential is of the form vo(E)=wo(E)+vres(E), where wo(E) is the standard Heine-Abarenkov type model potential and vres(E) the resonant non-local potential acting on d states. Two sets of wo(E) are used: the first one is local whereas the second set corresponds to a more accurate non-local form. When these two sets of parameters are applied in the calculation of phonon frequencies in noble metals, a good agreement is found between the experimental and computed results for all the noble metals on the use of the first set of parameters. The application of the second set of parameters gives a little improved dispersion results for Cu and Ag, but the dispersion curves for Au are deteriorated. Possible region of this deterioration has been discussed.
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A new method for the electronic structure of metals
Volker Heine, I. V. Abarenkov · Philosophical magazine · 1964 · 776 citations
J. W. Lynn, H. G. Smith, R. M. Nicklow · Physical review. B, Solid state · 1973 · 340 citations
Transition-Metal Pseudopotentials
Walter A. Harrison · Physical Review · 1969 · 293 citations
Natural Sciences, Chemistry, Physics +11
Phonon Frequencies in Copper at 49 and 298°K
R. M. Nicklow, G. Gilat, H. G. Smith et al. · Physical Review · 1967 · 252 citations