Analyticity of the density of electronic wavefunctions

DOI10.1007/BF02432911MaRDI QIDQ1880444zbMATH OpenOpenAlexFDO

Authors S. Fournais, Maria Hoffmann-Ostenhof, Thomas Hoffmann-Ostenhof, T.Østergaard Sørensen

Publication date 28 September 2004

Published in Arkiv för Matematik (Search for Journal in Brave)

Full work available at URL https://arxiv.org/abs/math-ph/0211075

zbMATH Keywords

singular perturbationsHamiltonianCoulomb potential

Mathematics Subject Classification ID

Schrödinger operator, Schrödinger equation (35J10) Singular perturbations in context of PDEs (35B25) General topics in linear spectral theory for PDEs (35P05) PDEs in connection with quantum mechanics (35Q40) Applications of operator theory in the physical sciences (47N50) Selfadjoint operator theory in quantum theory, including spectral analysis (81Q10) Molecular physics (81V55)

Abstract: We prove that the electronic densities of atomic and molecular eigenfunctions are real analytic in ${mathbbR}^3$ away from the nuclei.

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Cites work

• scientific article; zbMATH DE number 3678541 (Why is no real title available?)
• scientific article; zbMATH DE number 1984597 (Why is no real title available?)
• Electron wavefunctions and densities for atoms
• Local properties of Coulombic wave functions
• On the eigenfunctions of many-particle systems in quantum mechanics
• Schrödinger semigroups
• The electron density is smooth away from Nuclei

Cited in

(25)

• A discontinuous Galerkin scheme for full-potential electronic structure calculations
• On the analyticity of electronic reduced densities for molecules
• A new proof of the analyticity of the electronic density of molecules
• \({h-P}\) finite element approximation for full-potential electronic structure calculations
• Sharp regularity results for Coulombic many-electron wave functions
• Estimates on derivatives of coulombic wave functions and their electron densities
• Averaged electron densities of the helium-like atomic systems
• Tosio Kato's work on non-relativistic quantum mechanics. I
• On factorization of molecular wavefunctions
• From atoms to crystals: a mathematical journey
• Tosio Kato's work on non-relativistic quantum mechanics. II
• Real analyticity away from the nucleus of pseudorelativistic Hartree-Fock orbitals
• Electron wavefunctions and densities for atoms
• Hohenberg-Kohn theorem for Coulomb type systems and its generalization
• In search of the Hohenberg-Kohn theorem
• Numerical analysis of augmented plane wave methods for full-potential electronic structure calculations
• An analytic expression for the electronic correlation term of the kinetic functional
• Hohenberg-Kohn theorems for interactions, spin and temperature
• The diagonal behaviour of the one-particle Coulombic density matrix
• Analyticity of the one-particle density matrix
• Error estimates for Hermite and even-tempered Gaussian approximations in quantum chemistry
• Analytic structure of solutions to multiconfiguration equations
• Analytic structure of many-body Coulombic wave functions
• Asymptotic regularity of solutions to Hartree-Fock equations with Coulomb potential
• Upper bounds of local electronic densities in molecules

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