A Primer in Density Functional Theory

By: Carlos Fiolhais (Editor), Fernando Nogueira (Editor), Miguel A.L. Marques (Editor)

Write A Review

Hardcover | 1 August 2003

At a Glance

Hardcover
258 Pages

Dimensions(cm)
23.5 x 15.5 x 1.27

Hardcover

$124.67

or 4 interest-free payments of $31.17 with

or

Aims to ship in 7 to 10 business days

Density functional theory (DFT) is by now a well-established method for tackling the quantum mechanics of many-body systems. Originally applied to compute properties of atoms and simple molecules, DFT has quickly become a work horse for more complex applications in the chemical and materials sciences. The present set of lectures, spanning the whole range from basic principles to relativistic and time-dependent extensions of the theory, is the ideal introduction for graduate students or nonspecialist researchers wishing to familiarize themselves with both the basic and most advanced techniques in this field.

Shipping

	Standard Shipping	Express Shipping
Metro postcodes:	$9.99	$14.95
Regional postcodes:	$9.99	$14.95
Rural postcodes:	$9.99	$14.95

How to return your order

At Booktopia, we offer hassle-free returns in accordance with our returns policy. If you wish to return an item, please get in touch with Booktopia Customer Care.

Additional postage charges may be applicable.

Defective items

If there is a problem with any of the items received for your order then the Booktopia Customer Care team is ready to assist you.

For more info please visit our Help Centre.

More in Quantum & Theoretical Chemistry

Quantum Biocomputing in Quantum Biology Volume I : Arithmetic and Combinational Circuits - Hafiz MD Hasan Babu

$44.25

44%
OFF

Green Carbon Quantum Dots

Environmental Applications

Hardcover

RRP $106.05

$103.35

Problems in Finite Element Methods : Aubin Nitsche's Duality Process, Nodal Methods and Friedrichs Systems - Aref Jeribi

$121.50

13%
OFF

Molecular Orbitals of Transition Metal Complexes

Hardcover

RRP $201.00

$121.25

40%
OFF

Methods of Molecular Quantum Mechanics : An Introduction to Electronic Molecular Structure - Valerio Magnasco

$267.50

23%
OFF

Physical Chemistry

Quantum Chemistry and Molecular Interactions

Hardcover

RRP $197.95

$155.75

21%
OFF

Bohm-Biederman Correspondence

Creativity in Art and Science

Hardcover

RRP $284.00

$200.95

29%
OFF

Nuclear Magnetic Shieldings and Molecular Structure : Proceedings of the NATO ARW on "The Calculation of NMR Shielding Constants and Their Use in the Geometric and Electronic Structures of Molecules and Solids" College Park, MD, U. S. A. July 20-24, 1992

$26.50

Quantum Theory of Transport Properties of Single Molecules

Hardcover

RRP $406.00

$287.40

29%
OFF

Statistical Field Theory of Ion-Molecular Fluids : Fundamentals and Applications in Physical Chemistry and Electrochemistry - Yury A. Budkov

$222.90

29%
OFF

Molecular Simulation of Fluids

Theory, Algorithms and Object-Orientation

Paperback

RRP $352.95

$266.50

24%
OFF

Life on the Edge : The Coming of Age of Quantum Biology - Jim Al-Khalili

$343.75

41%
OFF

Density Functionals for Non-relativistic Coulomb Systems in the New Century	p. 1
Orbital-Dependent Functionals for the Exchange-Correlation Energy: A Third Generation of Density Functionals	p. 56
Relativistic Density Functional Theory	p. 123
Time-Dependent Density Functional Theory	p. 144
Density Functional Theories and Self-energy Approaches	p. 185
A Tutorial on Density Functional Theory	p. 218
Table of Contents provided by Blackwell. All Rights Reserved.

A Primer in Density Functional Theory

At a Glance

Hardcover

Shipping

How to return your order

Defective items

You Can Find This Book In

More in Quantum & Theoretical Chemistry

Quantum Biocomputing in Quantum Biology Volume I

Arithmetic and Combinational Circuits

Computational Methods in Physics

Compendium for Students

Information Theory

An Exploration Across Disciplines

Quantum Biocomputing in Quantum Biology Volume II

Memory Devices, Programmable Logic Devices, Nanoprocessors, Heat, Speed, and Data Related Issues

Valence Bond Methods

Theory and Applications

Green Carbon Quantum Dots

Environmental Applications

Problems in Finite Element Methods

Aubin Nitsche's Duality Process, Nodal Methods and Friedrichs Systems

Mathematics for Natural Scientists II

Advanced Methods

Molecular Orbitals of Transition Metal Complexes

Methods of Molecular Quantum Mechanics

An Introduction to Electronic Molecular Structure

Quantum Chemistry

Physical Chemistry

Quantum Chemistry and Molecular Interactions

Bohm-Biederman Correspondence

Creativity in Art and Science

Nuclear Magnetic Shieldings and Molecular Structure : Proceedings of the NATO ARW on "The Calculation of NMR Shielding Constants and Their Use in the Geometric and Electronic Structures of Molecules and Solids" College Park, MD, U. S. A. July 20-24, 1992

Mathematics and Its Applications

Quantum Mechanical Electronic Structure Calculations with Chemical Accuracy

Fluid Mechanics and Its Applications

Structure and Dynamics of Atoms and Molecules : Conceptual Trends

Simply Quantum Physics

Quantum Theory of Transport Properties of Single Molecules

Statistical Field Theory of Ion-Molecular Fluids

Fundamentals and Applications in Physical Chemistry and Electrochemistry

Structure-Based Drug Design

Computer-aided Drug Discovery and Design

Quantum Chemistry

Classical to Computational

Molecular Simulation of Fluids

Theory, Algorithms and Object-Orientation

Life on the Edge

The Coming of Age of Quantum Biology

Accurate Molecular Structures

Their Determination and Importance

This product is categorised by

Popular Searches