The density in a one-dimensional potential
asymptotic formulaestimates for the eigenvaluesground-state energy of an atomnormalized eigenfunctionsthe density
General spectral theory of ordinary differential operators (34L05) Asymptotic distribution of eigenvalues, asymptotic theory of eigenfunctions for ordinary differential operators (34L20) Particular ordinary differential operators (Dirac, one-dimensional Schrödinger, etc.) (34L40) Perturbation theories for operators and differential equations in quantum theory (81Q15) Atomic physics (81V45)
In [ibid. 95, No. 2, 145-305 (1992; Zbl 0797.34083)] we proved precise estimates for the eigenvalues \(E_ k\) and normalized eigenfunctions \(\varphi_ k\) of an ordinary differential operator \(H = - d^ 2/dx^ 2 + V(x)\) on an interval \(I_{\text{BVP}}\). In this paper, we apply these results to study the density \[ \rho (x) = \sum_{E_ k \leq 0} | \varphi_ k (x) |^ 2. \] We introduce a simple approximation \(\rho_{sc} (x)\) and estimate \(\rho-\rho_{sc}\). Our goal is proving the asymptotic formula announced in [Bull. Am. Math. Soc., New Ser. 23, No. 2, 525-530 (1990; Zbl 0722.35072)] for the ground-state energy of an atom. This requires estimates for \(\rho - \rho_{sc}\) in weighted Sobolev norms of order \(-1\), which we derive here. The complete proofs of the results are given here and in a series of further papers.
- Exact density functionals in one dimension
- The density in a three-dimensional radial potential
- The effective potential as an energy density: The one phase region
- On the Coulomb potential in one dimension
- Determination of density of elliptic potential
- The density in the density of states method
- Penetrability of a one-dimensional Coulomb potential
- Potential scattering in one dimension.
- Eigenvalues and eigenfunctions of ordinary differential operators
- Accuracy of mean field approximations for atoms and molecules
- The eigenvalue sum for a one-dimensional potential
- An upper bound on the ionic ground state density at the nucleus
- The density in a three-dimensional radial potential
- The eigenvalue sum for a three-dimensional radial potential
- Estimates on derivatives of coulombic wave functions and their electron densities
- Eigenvalue asymptotics for the one-particle kinetic energy density operator
- The ground state energy of heavy atoms: the leading correction
- The Scott conjecture for large Coulomb systems: a review
- Potential energies of one-dimensional systems at equilibrium.
- Slater sum for the one-dimensional sech2 potential in relation to the kinetic energy density
- A number-theoretic estimate for the thomas-fermi density
- Sharp Weyl laws with singular potentials
- The foundations of spectral computations via the solvability complexity index hierarchy
- On the computation of geometric features of spectra of linear operators on Hilbert spaces
- The Scott correction in Dirac-Fock theory
- The ground state energy of heavy atoms: Relativistic lowering of the leading energy correction
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