Physical review. A, General physics · 1979 · 83 citations · 13 references
Natural SciencesPhysicsCondensed Matter PhysicsQuantum MechanicsThermodynamicsCondensed Matter SimulationsCondensed Matter TheoryHigh-pressure ThermodynamicsStates Of MatterStatistical MechanicsStatistical ThermodynamicsElectron DensityElectron Density DistributionsElectron Density ProfilesEquation Of State Of Dense MatterNuclear Matter Equation Of StatePressure-density RelationThermodynamic AnalysisVirial Theorem
A new statistical model [the quantum-statistical model (QSM)] was recently introduced by Kalitkin and Kuzmina for the calculation of thermodynamic properties of compressed matter. This paper examines the QSM and gives (i) a numerical QSM calculation of pressure and energy for aluminum and comparison to existing augmented-plane-wave data; (ii) display of separate kinetic, exchange, and quantum pressure terms; (iii) a study of electron density at the nucleus; (iv) a study of the effects of the Kirzhnitz-Weizsacker parameter controlling the gradient terms; (v) an analytic expansion for very high densities; and (vi) rigorous pressure theorems including a general version of the virial theorem which applies to an arbitrary microscopic volume. It is concluded that the QSM represents the most accurate and consistent theory of the Thomas-Fermi type.
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Thermal Properties of the Inhomogeneous Electron Gas
N. David Mermin · Physical Review · 1965 · 2.8K citations
Virial Theorem in Self-Consistent-Field Calculations
David A. Liberman · Physical review. B, Solid state · 1971 · 165 citations
Natural Sciences, Chemistry, Physics +10