Analyticity of the density of electronic wavefunctions
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Singular perturbations in context of PDEs (35B25) Schrödinger operator, Schrödinger equation (35J10) 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 away from the nuclei.
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Cites work
- Electron wavefunctions and densities for atoms
- scientific article; zbMATH DE number 3678541 (Why is no real title available?)
- scientific article; zbMATH DE number 1984597 (Why is no real title available?)
- 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
(30)- Analytic structure of many-body Coulombic wave functions
- Tosio Kato's work on non-relativistic quantum mechanics. I
- Hohenberg-Kohn theorem for Coulomb type systems and its generalization
- Real analyticity away from the nucleus of pseudorelativistic Hartree-Fock orbitals
- Estimates on derivatives of coulombic wave functions and their electron densities
- Analyticity of the one-particle density matrix
- A discontinuous Galerkin scheme for full-potential electronic structure calculations
- Hohenberg-Kohn theorems for interactions, spin and temperature
- \({h-P}\) finite element approximation for full-potential electronic structure calculations
- Sharp regularity results for Coulombic many-electron wave functions
- On factorization of molecular wavefunctions
- Asymptotic regularity of solutions to Hartree-Fock equations with Coulomb potential
- Analytic structure of solutions to multiconfiguration equations
- In search of the Hohenberg-Kohn theorem
- A DECOMPOSITION THEOREM FOR WAVE FUNCTIONS IN MOLECULAR QUANTUM CHEMISTRY
- Tosio Kato's work on non-relativistic quantum mechanics. II
- On the analyticity of electronic reduced densities for molecules
- Averaged electron densities of the helium-like atomic systems
- An analytic expression for the electronic correlation term of the kinetic functional
- Numerical analysis of augmented plane wave methods for full-potential electronic structure calculations
- From atoms to crystals: a mathematical journey
- Electron wavefunctions and densities for atoms
- A new proof of the analyticity of the electronic density of molecules
- The diagonal behaviour of the one-particle Coulombic density matrix
- Upper bounds of local electronic densities in molecules
- Boundedness of the fifth derivative for the one-particle coulombic density matrix at the diagonal
- Numerical analysis of multi-patch discontinuous Galerkin isogeometric method for full-potential electronic structure calculations
- Eigenvalue estimates for the Coulombic one-particle density matrix and the kinetic energy density matrix
- Regularity of the (N-1)-particle electronic reduced density matrix for molecules with fixed nuclei and N electrons.
- Error estimates for Hermite and even-tempered Gaussian approximations in quantum chemistry
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