Pages that link to "Item:Q1006862"

The following pages link to A new approach to the modeling of local defects in crystals: The reduced Hartree-Fock case (Q1006862):

Displaying 44 items.

• Analysis of boundary conditions for crystal defect atomistic simulations (Q338109) (← links)
• Bloch bundles, Marzari-Vanderbilt functional and maximally localized Wannier functions (Q358806) (← links)
• A homogenization analysis of the field theoretic approach to the quasi-continuum method (Q361432) (← links)
• Mean-field models for disordered crystals (Q388181) (← links)
• Local defects are always neutral in the Thomas-Fermi-von Weiszäcker theory of crystals (Q715348) (← links)
• Ground state and charge renormalization in a nonlinear model of relativistic atoms (Q731301) (← links)
• The dielectric permittivity of crystals in the reduced Hartree-Fock approximation (Q993330) (← links)
• Properties of periodic Hartree-Fock minimizers (Q1016340) (← links)
• The thermodynamic limit of quantum Coulomb systems. II: Applications (Q1016480) (← links)
• Localised solutions of Hartree equations for narrow-band crystals (Q1119835) (← links)
• Oxygen in the MgO crystal. A local approach (Q1405615) (← links)
• Block circulant and Toeplitz structures in the linearized Hartree-Fock equation on finite lattices: tensor approach (Q1692720) (← links)
• Thermodynamic limit of crystal defects with finite temperature tight binding (Q1783964) (← links)
• A numerical study of the extended Kohn-Sham ground states of atoms (Q1789235) (← links)
• A positive density analogue of the Lieb-Thirring inequality (Q1942105) (← links)
• Generalized Weyl theorems and spectral pollution in the Galerkin method (Q1943736) (← links)
• A mathematical formulation of the random phase approximation for crystals (Q1947421) (← links)
• Mean-field model for the junction of two quasi-1-dimensional quantum Coulomb systems (Q2020192) (← links)
• The nonlinear Schrödinger equation for orthonormal functions: existence of ground states (Q2032399) (← links)
• Split representation of adaptively compressed polarizability operator (Q2050851) (← links)
• On the reduced Hartree-Fock equations with a small Anderson type background charge distribution (Q2088087) (← links)
• Screening in the finite-temperature reduced Hartree-Fock model (Q2192400) (← links)
• On derivation of the Poisson-Boltzmann equation (Q2194194) (← links)
• On the modeling of interactions between polarons in quantum cristals (Q2354220) (← links)
• The reduced Hartree-Fock model for short-range quantum crystals with nonlocal defects (Q2510711) (← links)
• Numerical stability and efficiency of response property calculations in density functional theory (Q2689099) (← links)
• QM/MM methods for crystalline defects. I: Locality of the tight binding model (Q2806407) (← links)
• Convergence rates of supercell calculations in the reduced Hartree-Fock model (Q2830703) (← links)
• Mathematical modeling of point defects in materials science (Q2868590) (← links)
• The Microscopic Origin of the Macroscopic Dielectric Permittivity of Crystals: A Mathematical Viewpoint (Q2897259) (← links)
• Mean-field electronic structure models for disordered materials (Q2929306) (← links)
• APPLICATIONS OF MAGNETIC ΨDO TECHNIQUES TO SAPT (Q3002985) (← links)
• Point defects in tight binding models for insulators (Q3388782) (← links)
• Variational methods in relativistic quantum mechanics (Q3528012) (← links)
• A reduced Hartree–Fock model of slice-like defects in the Fermi sea (Q4972333) (← links)
• The Kohn-Sham equation for deformed crystals (Q4979161) (← links)
• (Q5190868) (← links)
• Numerical methods for Kohn–Sham density functional theory (Q5230523) (← links)
• The reduced Hartree-Fock model with self-generated magnetic fields (Q5234068) (← links)
• Geometry equilibration of crystalline defects in quantum and atomistic descriptions (Q5237781) (← links)
• Adaptively Compressed Polarizability Operator for Accelerating Large Scale <i>Ab Initio</i> Phonon Calculations (Q5737743) (← links)
• Dirac cones for a mean-field model of graphene (Q6123305) (← links)
• On an effective equation of the reduced Hartree-Fock theory (Q6175431) (← links)
• Existence of minimizers for the Dirac-Fock model of crystals (Q6583721) (← links)