Kinetic energy density and Pauli potential: dimensionality dependence, gradient expansions and non-locality
- 21 September 1991
- journal article
- Published by IOP Publishing in Journal of Physics A: General Physics
- Vol. 24 (18) , 4249-4260
- https://doi.org/10.1088/0305-4470/24/18/013
Abstract
For arbitrary level filling, the fully non-local kinetic energy density and Pauli potential for the one-dimensional harmonic oscillator can be constructed explicitly. These exact results are eventually compared with the low-order gradient expansions. This prompts a fuller study of the dimensionality dependence of low-order gradient expansions for systems with general one-body potentials, and its relevance to the theory of the Pauli potential. One consequence of the present work is to display the generalization to D-dimensions as (D-2)/3D of the three-dimensional Kirzhnits coefficient (1957) 1/9 of the von Weizsacker term in the kinetic energy density.Keywords
This publication has 15 references indexed in Scilit:
- Single-Particle Kinetic Energy for N Fermions in One-Dimension: General and Model ResultsEurophysics Letters, 1990
- Exact single-particle kinetic energy functional for general two-level and modeln-level one-dimensional systems: Dependence only on electron density and its gradientPhysical Review A, 1989
- Some tests of an approximate density functional for the ground-state kinetic energy of a fermion systemPhysical Review A, 1988
- One-dimensional kinetic energy density functionals compatible with the differential virial theoremJournal of Physics A: General Physics, 1987
- One-dimensional hypervirial theorems in density functional theoryPhysics Letters A, 1985
- Sum rules and static local-field corrections of electron liquids in two and three dimensionsPhysical Review A, 1984
- Exact local density method for linear harmonic oscillatorThe Journal of Chemical Physics, 1979
- Quantum Corrections to the Thomas–Fermi Approximation—The Kirzhnits MethodCanadian Journal of Physics, 1973
- Density functional theory and the von Weizsacker methodJournal of Physics C: Solid State Physics, 1971
- Inhomogeneous Electron GasPhysical Review B, 1964