Chemistry BooksQuantum Chemistry Books

Nature of the Chemical Bond

Advertisement

Nature of the Chemical Bond

Nature of the Chemical Bond

This book explains the basic elements of quantum mechanics with some treatment of the hydrogen atom, the harmonic oscillator, and angular momentum. It will concentrate on the explanation of the structure and reactivity of molecules using quantum mechanical ideas.

Author(s):

s300 Pages
Similar Books
Advanced Quantum Chemistry by Patrik R. Callis

Advanced Quantum Chemistry by Patrik R. Callis

Scope of this note is to explain applications of quantum mechanics to many-electron atoms and molecules, concentrating on stationary and time-dependent electronic and vibrational states. Topics covered includes: Need for quantum mechanics, Quantum concepts and understanding quantum mechanics, Brief review of operators, wavefunctions, and the Schrodinger equation with and without time, wavefunction curvature, kinetic energy, and tunneling, Nodal properties of 3D wavefunctions for various shapes, Physical relevance and the Rules of Quantum Mechanics, Variation principle, linear variation method, and perturbation limit, Born-Oppenheimer approximation, Integration of symmetry and group theory in the context of quantum mechanics, Time dependent Schrodinger Equation, Time Dependence of Probability Density, Atom-centered Density Matrix Propagation.

sNA Pages
Quantum         Computation

Quantum Computation

This note covers the following topics: quantum information theory, quantum algorithms, and quantum error correction.

sNA Pages
Lectures on Advanced Quantum Mechanics

Lectures on Advanced Quantum Mechanics

This book explains the following topics: The Dirac Theory, Scattering Problems and Born Approximation, Field Theory, Examples of Quantized Field Theories, Free Particle Scattering Problems, General Theory of Free Particle Scattering and Scattering By a Static Potential.

s149 Pages
Advanced Quantum Chemistry

Advanced Quantum Chemistry

This book explains the following topics: Many-electron quantum mechanics, Exact and approximate wave functions, The Hartree–Fock theory, Configuration interaction, Coupled-cluster theory, Basis sets and molecular integrals, Accounting for the effects of special relativity, Second quantization and Performance of the electronic-structure models.

s124 Pages
Introductory Quantum Mechanics I

Introductory Quantum Mechanics I

This lecture note written by Prof. Troy Van Voorhis covers the fundamental concepts of quantum mechanics: wave properties, uncertainty principles, Schrodinger equation, and operator and matrix methods.

sNA Pages
Quantum Chemistry

Quantum Chemistry

This book covers the following topics: The Old Quantum Theory, Principles Of Classical Mechanics, Principles Op Quantum Mechanics, The Quantum Mechanics Of Some Simple Systems, The Hydrogen Atom, Atomic Structure, Group Theory, Electronic States Of Diatomic Molecules, Elements Op Quantum Statistical Mechanics, The Principles Of Molecular Spectroscopy.

s410 Pages
Nature of the Chemical Bond

Nature of the Chemical Bond

This book explains the basic elements of quantum mechanics with some treatment of the hydrogen atom, the harmonic oscillator, and angular momentum. It will concentrate on the explanation of the structure and reactivity of molecules using quantum mechanical ideas.

s300 Pages
Introduction to Electronic Structure Theory

Introduction to Electronic Structure Theory

This note covers the following topics: What is Electronic Structure Theory, Properties Predicted by Electronic Structure Theory, Postulates of Quantum Mechanics, Dirac Notation, Slater Determinants, Simplified Notation for the Hamiltonian, Matrix Elements of the Hamiltonian and One- and Two-Electron Integrals.

sNA Pages

Advertisement