On the thermodynamic limit for Hartree-Fock type models
From MaRDI portal
Publication:5953874
DOI10.1016/S0294-1449(00)00059-7zbMath0994.35115OpenAlexW2045959359MaRDI QIDQ5953874
Isabelle Catto, Pierre-Louis Lions, Claude Le Bris
Publication date: 7 October 2002
Published in: Annales de l'Institut Henri Poincaré. Analyse Non Linéaire (Search for Journal in Brave)
Full work available at URL: http://www.numdam.org/item?id=AIHPC_2001__18_6_687_0
Thermodynamics of continua (80A17) Continuum models (systems of particles, etc.) arising in equilibrium statistical mechanics (82B21) Molecular physics (81V55)
Related Items
Coulomb and Riesz gases: The known and the unknown, Hartree-Fock theory with a self-generated magnetic field, Variational projector-augmented wave method: a full-potential approach for electronic structure calculations in solid-state physics, A variational framework for spectral approximations of Kohn-Sham density functional theory, The Microscopic Origin of the Macroscopic Dielectric Permittivity of Crystals: A Mathematical Viewpoint, Elliptic Equations with Multi-Singular Inverse-Square Potentials and Critical Nonlinearity, On the crystal ground state in the Schrödinger-Poisson model with point ions, An exact estimate result for a semilinear equation with critical exponent and prescribed singularity, Bloch bundles, Marzari-Vanderbilt functional and maximally localized Wannier functions, Gagliardo-Nirenberg and Caffarelli-Kohn-Nirenberg interpolation inequalities associated with Coulomb-Sobolev spaces, The energy of some microscopic stochastic lattices, Mean-field models for disordered crystals, Dirichlet problems involving the Hardy-Leray operators with multiple polars, Screening in the finite-temperature reduced Hartree-Fock model, Dirac cones for a mean-field model of graphene, On derivation of the Poisson-Boltzmann equation, On an effective equation of the reduced Hartree-Fock theory, On Orbital Stability of Ground States for Finite Crystals in Fermionic Schrödinger--Poisson Model, Existence and nonexistence of HOMO-LUMO excitations in Kohn-Sham density functional theory, On stability of ground states for finite crystals in the Schrödinger–Poisson model, The elastic continuum limit of the tight binding model, On the linear stability of crystals in the Schrödinger-Poisson model, Weighted Hardy inequalities and Ornstein-Uhlenbeck type operators perturbed by multipolar inverse square potentials, On the dispersion decay for crystals in the linearized Schrödinger-Poisson model, Mean-field model for the junction of two quasi-1-dimensional quantum Coulomb systems, Local defects are always neutral in the Thomas-Fermi-von Weiszäcker theory of crystals, On the Schrödinger-Poisson-Slater system: behavior of minimizers, radial and nonradial cases, Thermodynamic limit of crystal defects with finite temperature tight binding, The dielectric permittivity of crystals in the reduced Hartree-Fock approximation, Atomistic to Continuum limits for computational materials science, A numerical study of the extended Kohn-Sham ground states of atoms, The nonlinear Schrödinger equation for orthonormal functions: existence of ground states, The reduced Hartree-Fock model for short-range quantum crystals with nonlocal defects, QM/MM Methods for Crystalline Defects. Part 1: Locality of the Tight Binding Model, A new approach to the modeling of local defects in crystals: The reduced Hartree-Fock case, Ground state of semilinear elliptic systems with sum of periodic and Hardy potentials, Properties of periodic Hartree-Fock minimizers, The thermodynamic limit of quantum Coulomb systems. II: Applications, A reduced Hartree–Fock model of slice-like defects in the Fermi sea, Point defects in tight binding models for insulators, Convergence rates of supercell calculations in the reduced Hartree−Fock model, The reduced Hartree-Fock model with self-generated magnetic fields, Existence of minimizers for Kohn-Sham models in quantum chemistry, Improved Multipolar Hardy Inequalities, On the reduced Hartree-Fock equations with a small Anderson type background charge distribution, On the Crystal Ground State in the Schrödinger--Poisson Model, Multipolar Hardy inequalities in \(L^p\)-spaces, MATHEMATICAL MODELING OF POINT DEFECTS IN MATERIALS SCIENCE, On the modeling of interactions between polarons in quantum cristals, On some periodic Hartree-type models for crystals
Cites Work
- Proof of the ionization conjecture in a reduced Hartree-Fock model
- Universality in the Thomas-Fermi-von Weizsäcker model of atoms and molecules
- Infinite-dimensional dynamical systems in mechanics and physics
- Error bound for the Hartree-Fock energy of atoms and molecules
- Theory of Bloch waves
- The constitution of matter: existence of thermodynamics for systems composed of electrons and nuclei.
- The Thomas-Fermi theory of atoms, molecules and solids
- On Wigner measures
- Pair correlations and exchange phenomena in the free electron gas
- On some periodic Hartree-type models for crystals
- Solutions of Hartree-Fock equations for Coulomb systems
- Generalized Hartree-Fock theory and the Hubbard model
- The stability of matter: from atoms to stars
- Thomas-fermi and related theories of atoms and molecules
- Sur la limite thermodynamique pour des modèles de type Hartree et Hartree-Fock
- Asymptotics of heavy atoms in high magnetic fields: I. Lowest landau band regions
- Homogenization of Periodic Structures via Bloch Decomposition
- Band-Gap Structure of Spectra of Periodic Dielectric and Acoustic Media. I. Scalar Model
- Band-Gap Structure of Spectra of Periodic Dielectric and Acoustic Media. II. Two-Dimensional Photonic Crystals
- Floquet theory for partial differential equations
- Perturbation theory for the Schrödinger operator with a periodic potential
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item