Many Particle Hardy-Inequalities

In this paper we prove three differenttypes of the so-called many-particle Hardy inequalities. One of them is a "classical type" which is valid in any dimesnion $d\neq 2$. The second type deals with two-dimensional magnetic Dirichlet forms where every particle is supplied with a soplenoid. Finally we show that Hardy inequalities for Fermions hold true in all dimensions.Comment: 20 page

Analyticity of the density of electronic wavefunctions

We prove that the electronic densities of atomic and molecular eigenfunctions are real analytic in ${\mathbb R}^3$ away from the nuclei.Comment: 19 page

ANALYTIC STRUCTURE OF SOLUTIONS TO MULTICONFIGURATION EQUATIONS

Abstract. We study the regularity at the positions of the (fixed) nuclei of solutions to (non-relativistic) multiconfiguration equations (including Hartree–Fock) of Coulomb systems. We prove the following: Let {ϕ1,..., ϕM} be any solution to the rank–M multiconfiguration equations for a molecule with L fixed nuclei at R1,..., RL ∈ R 3. Then, for any j ∈ {1,..., M}, k ∈ {1,..., L}, there exists a neighbourhood Uj,k ⊆ R 3 of Rk, and functions ϕ (1) j,k, ϕ(2) j,k, real analytic in Uj,k, such that ϕj(x) = ϕ (1) (2) j,k (x) + |x − Rk|ϕ j,k (x), x ∈ Uj,k. A similar result holds for the corresponding electron density. The proof uses the Kustaanheimo–Stiefel transformation, as applied in [9] to the study of the eigenfunctions of the Schrödinger operator of atoms and molecules near two-particle coalescence points. 1. Introduction an

The electron density is smooth away from the nuclei

We prove that the electron densities of electronic eigenfunctions of atoms and molecules are smooth away from the nuclei.Comment: 16 page

Sharp regularity results for many-electron wave functions

We show that electronic wave functions Psi of atoms and molecules have a representation Psi=F*phi, where F is an explicit universal factor, locally Lipschitz, and independent of the eigenvalue and the solution Psi itself, and phi has locally bounded second derivatives. This representation turns out to be optimal as can already be demonstrated with the help of hydrogenic wave functions. The proofs of these results are, in an essential way, based on a new elliptic regularity result which is of independent interest. Some identities that can be interpreted as cusp conditions for second order derivatives of Psi are derived.Comment: 43 page

On spectral minimal partitions II, the case of the rectangle

In continuation of \cite{HHOT}, we discuss the question of spectral minimal 3-partitions for the rectangle $]-\frac a2,\frac a2[\times ] -\frac b2,\frac b2[$, with $0< a\leq b$. It has been observed in \cite{HHOT} that when $0<\frac ab < \sqrt{\frac 38}$ the minimal 3-partition is obtained by the three nodal domains of the third eigenfunction corresponding to the three rectangles $]-\frac a2,\frac a2[\times ] -\frac b2,-\frac b6[$, $]-\frac a2,\frac a2[\times ] -\frac b6,\frac b6[$ and $]-\frac a2,\frac a2[\times ] \frac b6, \frac b2[$. We will describe a possible mechanism of transition for increasing $\frac ab$ between these nodal minimal 3-partitions and non nodal minimal 3-partitions at the value $\sqrt{\frac 38}$ and discuss the existence of symmetric candidates for giving minimal 3-partitions when $\sqrt{\frac 38}<\frac ab \leq 1$. Numerical analysis leads very naturally to nice questions of isospectrality which are solved by introducing Aharonov-Bohm Hamiltonians or by going on the double covering of the punctured rectangle