List of Books in Keyword #Electronic Structure

Fundamentals of Quantum Chemistry: Molecular Spectroscopy and Modern Electronic Structure Computations
Published on: 2001
Beginner Unordered English

This text is designed as a practical introduction to quantum chemistry. Quantum chemistry is applied to explain and predict molecular …

Quantum Chemistry Molecular Spectroscopy Electronic Structure Computation Theoretical Methods
Modern Quantum Chemistry: Introduction to Advanced Electronic Structure Theory
Published on: 1996
Beginner Atom English

Graduate-level text explains modern in-depth approaches to the calculation of the electronic structure and properties of molecules. Hartree-Fock approximation, electron …

Quantum Chemistry Electronic Structure Advanced Theory Ab Initio Computational Methods
Density Functional Theory: An Advanced Course (Theoretical and Mathematical Physics)
Published on: 2011
Unordered Condensed Matter English

Density Functional Theory (DFT) has firmly established itself as the workhorse for atomic-level simulations of condensed phases, pure or composite …

Quantum Chemistry Electronic Structure DFT Calculations Wavefunctions Approximation Methods
Quantum Chemistry: The Challenge of Transition Metals and Coordination Chemistry
Published on: 1986
Beginner Unordered English

Over the last twenty years, developments of the ab initio metho­ dologies and of the computing capacities have progressively turned …

Quantum Chemistry Transition Metals Coordination Chemistry Computational Methods Electronic Structure

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