A Mathematical Introduction to Electronic Structure Theory

DOI10.1137/1.9781611975802zbMath1435.81001OpenAlexW2948693473MaRDI QIDQ5232168

Lin Lin, Jian-feng Lu

Publication date: 29 August 2019

Full work available at URL: https://doi.org/10.1137/1.9781611975802

zbMATH Keywords

density functional theorylinear response theoryelectronic structure theoryKohn-Sham

Mathematics Subject Classification ID

Many-body theory; quantum Hall effect (81V70) Statistical mechanics of solids (82D20) Irreversible thermodynamics, including Onsager-Machlup theory (82C35) Irreversible thermodynamics, including Onsager-Machlup theory (82B35) Introductory exposition (textbooks, tutorial papers, etc.) pertaining to statistical mechanics (82-01) Introductory exposition (textbooks, tutorial papers, etc.) pertaining to quantum theory (81-01) Quantum state spaces, operational and probabilistic concepts (81P16) Computational density functional analysis in statistical mechanics (82M36)

Related Items (5)

Gradient Flow Finite Element Discretisations with Energy-Based Adaptivity for Excited States of Schrödinger's Equation ⋮ Numerical stability and efficiency of response property calculations in density functional theory ⋮ A heuristic independent particle approximation to determinantal point processes ⋮ Numerical methods for Kohn–Sham density functional theory ⋮ Convergence Analysis of Direct Minimization and Self-Consistent Iterations

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