The Microscopic Origin of the Macroscopic Dielectric Permittivity of Crystals: A Mathematical Viewpoint

The purpose of this paper is to provide a mathematical analysis of the Adler-Wiser formula relating the macroscopic relative permittivity tensor to the microscopic structure of the crystal at the atomic level. The technical level of the presentation is kept at its minimum to emphasize the mathematical structure of the results. We also briefly review some models describing the electronic structure of finite systems, focusing on density operator based formulations, as well as the Hartree model for perfect crystals or crystals with a defect.Comment: Proceedings of the Workshop "Numerical Analysis of Multiscale Computations" at Banff International Research Station, December 200

Existence of Atoms and Molecules in the Mean-Field Approximation of No-Photon Quantum Electrodynamics

The Bogoliubov-Dirac-Fock (BDF) model is the mean-field approximation of no-photon Quantum Electrodynamics. The present paper is devoted to the study of the minimization of the BDF energy functional under a charge constraint. An associated minimizer, if it exists, will usually represent the ground state of a system of $N$ electrons interacting with the Dirac sea, in an external electrostatic field generated by one or several fixed nuclei. We prove that such a minimizer exists when a binding (HVZ-type) condition holds. We also derive, study and interpret the equation satisfied by such a minimizer. Finally, we provide two regimes in which the binding condition is fulfilled, obtaining the existence of a minimizer in these cases. The first is the weak coupling regime for which the coupling constant $\alpha$ is small whereas $\alpha Z$ and the particle number $N$ are fixed. The second is the non-relativistic regime in which the speed of light tends to infinity (or equivalently $\alpha$ tends to zero) and $Z$, $N$ are fixed. We also prove that the electronic solution converges in the non-relativistic limit towards a Hartree-Fock ground state.Comment: Final version, to appear in Arch. Rat. Mech. Ana

Spurious Modes in Dirac Calculations and How to Avoid Them

In this paper we consider the problem of the occurrence of spurious modes when computing the eigenvalues of Dirac operators, with the motivation to describe relativistic electrons in an atom or a molecule. We present recent mathematical results which we illustrate by simple numerical experiments. We also discuss open problems.Comment: Chapter to be published in the book "Many-Electron Approaches in Physics, Chemistry and Mathematics: A Multidisciplinary View", edited by Volker Bach and Luigi Delle Sit

Spectral Pollution and How to Avoid It (With Applications to Dirac and Periodic Schr\"odinger Operators)

This paper, devoted to the study of spectral pollution, contains both abstract results and applications to some self-adjoint operators with a gap in their essential spectrum occuring in Quantum Mechanics. First we consider Galerkin basis which respect the decomposition of the ambient Hilbert space into a direct sum $H=PH\oplus(1-P)H$, given by a fixed orthogonal projector $P$, and we localize the polluted spectrum exactly. This is followed by applications to periodic Schr\"odinger operators (pollution is absent in a Wannier-type basis), and to Dirac operator (several natural decompositions are considered). In the second part, we add the constraint that within the Galerkin basis there is a certain relation between vectors in $PH$ and vectors in $(1-P)H$. Abstract results are proved and applied to several practical methods like the famous "kinetic balance" of relativistic Quantum Mechanics.Comment: Proceedings of the London Mathematical Society (2009) in pres

The recent extension of muskwari sorghums in northern Cameroon

The extension of transplanted sorghum in northern Cameroon began in the 1950s and is now attaining remarkable proportions. It concerns from 150,000 to 200 000 ha throughout the plains in the extreme north according to the climatic conditions of the year. This spread has been caused mainly by the increase in food crop requirements resulting from population increase and also the development of cotton growing on land previously used for rainfed food crops. Studies have been performed at the local area ('terroir') level to gain a better understanding of the reasons for the phenomenon and its effects on farming systems. The spread can be as much as 200% in 20 years and is on vertisols and also seemingly less propitious vertic soils. It has been made possible by the perfecting of cultivation techniques and the endogenous dissemination of farming know-how, with an astonishing diversity of environments and varieties cultivated. Growers using the cropping system are encountering new constraints-especially weed growth- and are calling for external aid. An R&D programme initiated by the DPGT project (Développement Paysannal et Gestion des Terroirs) is leading to support services managed collectively by farmers' organisations. (Résumé d'auteur

A Connection between Submillimeter Continuum Flux and Separation in Young Binaries

We have made sensitive 800-micron continuum observations of low-mass, pre-main sequence (PMS) binary stars with projected separations less than 25 AU in Taurus-Auriga to study disks in the young binary environment. We did not detect any of the observed binaries, with typical 3-sigma upper limits of about 30 mJy. Combining our observations with previous 1300-micron observations of PMS Taurus binaries by Beckwith et al. (1990) and others, we find that the submillimeter fluxes from binaries with projected separations between 1 AU and 50 AU are significantly lower than fluxes from binaries with projected separations > 50 AU. The submillimeter fluxes from the wider binaries are consistent with those of PMS single stars. This may indicate lower disk surface densities and masses in the close binaries. Alternatively, dynamical clearing of gaps by close binaries is marginally sufficient to lower their submillimeter fluxes to the observed levels, even without reduction of surface densities elsewhere in the disks.Comment: 12 pages, uuencoded compressed postscript with figures; Wisconsin Astrophysics 526; to appear in ApJ Letter