Molecular Physics · 2014 · 17 citations · 23 references
Natural SciencesMaterials SciencePhysicsCondensed Matter PhysicsMaterials PhysicsSolid State PhysicsAb Initio MethodsElectrical ConductivityHeat ConductionStrongly Correlated Electron SystemsThermal Properties Of MaterialsTransport PropertiesElectrical ResistivityElectrical Transport PropertiesFermi LevelPseudopotentialsTemperature DependenceTemperature-dependent ResistivityTemperature-dependent TransportThermal Conductivity
We present the calculations of electrical resistivity, thermo-electric power and thermal conductivity based on the self-consistent approximation. The pseudopotential due to Hasegawa et al. [J. Non-Cryst. Solids 117/118, 300 (1990) M. Hasegawa, K. Hoshino, M. Watabe, and H. Young, J. Non-Cryst. Solids 117/118, 300 (1990).[Crossref], [Web of Science ®] , [Google Scholar]] for full electron–ion interaction, which is valid for all electrons and contains the repulsive delta function to achieve the necessary s-pseudisation, was used in the calculation. Temperature dependence of structure factor is achieved through temperature-dependent potential parameter in the pair-potential. The outcome of the present study is discussed in the light of other such results and with predictions of Wiedemann and Franz law up to moderately high temperature. Specially, high-temperature resistivity data necessitates the careful investigation of electron energy dispersion close to the Fermi level and possible metal to non-metal transition while going from dense-fluid to low density-fluid state. In the absence of experimental data at high temperature, these findings may serve as future guideline.
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Electron-ion pseudopotentials in metals
N. W. Ashcroft · Physics Letters · 1966 · 1.2K citations
Natural Sciences, Materials Engineering, Materials Science +11
A theory of the electrical properties of liquid metals II. Polyvalent metals
C. C. Bradley, T. E. Faber, E. G. Wilson et al. · Philosophical magazine · 1962 · 411 citations