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# Electronic Structure Theory

E-Books for free online viewing and/or download

## e-books in this category

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**Electronic Structure Methods**

- **Wikipedia** , **2014**

Contents: Electron configuration; Tight binding; Nearly free electron model; Hartree-Fock method; Modern valence bond; Generalized valence bond; Moller-Plesset perturbation theory; Configuration interaction; Coupled cluster; etc.

(**1634** views)

**Introduction to Electronic Structure Methods**

by **Ursula Röthlisberger, Ivano Tavernelli** - **EPFL** , **2011**

The text introduces the basic notions of computational quantum chemistry, which allow to explore reaction mechanisms and explain observations of laboratory reactions. Methods for quantum chemistry can also be applied to solid state physics problems.

(**966** views)

**Lecture Series in Electronic Structure Theory**

by **David Sherrill, et al.** - **Georgia Tech** , **2002**

From the table of contents: Intro to Electronic Structure Theory; Integral Notation and Hartree-Fock MO Theory; Basis Sets; Configuration Interaction; Density Functional Theory; Many-body Perturbation Theory; Coupled-cluster Theory.

(**995** views)

**Methods of Electronic Structure Theory**

by **Raffaele Resta** , **1996**

From the table of contents: theory of the electronic ground state; screening and electrostatics; formal linear response theory; electron gas results; pseudopotential perturbation theory; ground state of periodic solids; lattice dynamics.

(**1283** views)

**Geometry and Topology in Electronic Structure Theory**

by **Raffaele Resta** - **University of Trieste** , **2012**

From the table of contents: Introduction; Early discoveries; Berry-ology (geometry in nonrelativistic quantum mechanics); Manifestations of the Berry phase; Modern theory of polarization; Quantum metric and the theory of the insulating state.

(**1812** views)

**Computational Electronic Structure Theory**

by **Patrick Rinke** - **Fritz Haber Institute** , **2011**

The ever growing field of Computational electronic structure theory combines theoretical physics and chemistry, math and computer science. The goal is to have a theory that accurately and reliably predicts material properties from first principles.

(**1926** views)

**Lecture Notes in Computational Chemistry: Electronic Structure Theory**

by **Jurg Hutter** - **University of Zurich** , **2005**

Contents: Basic Quantum Mechanics; Basic Mathematical Review; Molecular Hamiltonian; Two-Electron Systems and Spin; Hartree-Fock Approximation; Molecular Orbital Theory; Correlation Energy; Coupled Cluster Approaches; and more.

(**3321** views)

**Molecular Electronic Structures: an introduction**

by **Carl J. Ballhausen, Harry B. Gray** - **Benjamin-Cummings Publishing Co.** , **1980**

An introduction to molecular electronic structural theory, concentrating on the description of ground state electronic structures - the principles of chemical bonding in molecules. Familiarity with differential and integral calculus is required.

(**5788** views)

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