Electronic structure : (Record no. 24694)

MARC details
000 -LEADER
fixed length control field 03131cam a22002774a 4500
003 - CONTROL NUMBER IDENTIFIER
control field CUTN
005 - DATE AND TIME OF LATEST TRANSACTION
control field 20180412143855.0
008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION
fixed length control field 090227s2008 enka b 001 0 eng
020 ## - INTERNATIONAL STANDARD BOOK NUMBER
International Standard Book Number 9780521534406
041 ## - LANGUAGE CODE
Language English
042 ## - AUTHENTICATION CODE
Authentication code pcc
082 00 - DEWEY DECIMAL CLASSIFICATION NUMBER
Classification number 530.411
Edition number 22
Item number MAR
100 1# - MAIN ENTRY--PERSONAL NAME
Personal name Martin, Richard M.,
245 10 - TITLE STATEMENT
Title Electronic structure :
Remainder of title basic theory and practical methods /
Statement of responsibility, etc Richard M. Martin.
250 ## - EDITION STATEMENT
Edition statement 1st pbk. ed. with corrections
260 ## - PUBLICATION, DISTRIBUTION, ETC. (IMPRINT)
Place of publication, distribution, etc Cambridge, UK ;
-- New York :
Name of publisher, distributor, etc Cambridge University Press,
Date of publication, distribution, etc 2008.
300 ## - PHYSICAL DESCRIPTION
Extent xxii, 624 p. :
Other physical details ill. ;
Dimensions 26 cm.
500 ## - GENERAL NOTE
General note The study of the electronic structure of materials is at a momentous stage, with the emergence of computational methods and theoretical approaches. Many properties of materials can now be determined directly from the fundamental equations for the electrons, providing insights into critical problems in physics, chemistry, and materials science. This book provides a unified exposition of the basic theory and methods of electronic structure, together with instructive examples of practical computational methods and real-world applications. Appropriate for both graduate students and practising scientists, this book describes the approach most widely used today, density functional theory, with emphasis upon understanding the ideas, practical methods and limitations. Many references are provided to original papers, pertinent reviews, and widely available books. Included in each chapter is a short list of the most relevant references and a set of exercises that reveal salient points and challenge the reader.
505 ## - FORMATTED CONTENTS NOTE
Contents Preface; Acknowledgements; Notation; Part I. Overview and Background Topics: 1. Introduction; 2. Overview; 3. Theoretical background; 4. Periodic solids and electron bands; 5. Uniform electron gas and simple metals; Part II. Density Functional Theory: 6. Density functional theory: foundations; 7. The Kohn-Sham ansatz; 8. Functionals for exchange and correlation; 9. Solving the Kohn-Sham equations; Part III. Important Preliminaries on Atoms: 10. Electronic structure of atoms; 11. Pseudopotentials; Part IV. Determination of Electronic Structure, The Three Basic Methods: 12. Plane waves and grids: basics; 13. Plane waves and grids: full calculations; 14. Localized orbitals: tight binding; 15. Localized orbitals: full calculations; 16. Augmented functions: APW, KKR, MTO; 17. Augmented functions: linear methods; Part V. Predicting Properties of Matter from Electronic Structure - Recent Developments: 18. Quantum molecular dynamics (QMD); 19. Response functions: photons, magnons ...; 20. Excitation spectra and optical properties; 21. Wannier functions; 22. Polarization, localization and Berry's phases; 23. Locality and linear scaling O (N) methods; 24. Where to find more; Appendixes; References; Index.
650 #0 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name as entry element Electronic structure.
942 ## - ADDED ENTRY ELEMENTS (KOHA)
Source of classification or shelving scheme Dewey Decimal Classification
Koha item type General Books
100 1# - MAIN ENTRY--PERSONAL NAME
Dates associated with a name 1942-
504 ## - BIBLIOGRAPHY, ETC. NOTE
Bibliography, etc Includes bibliographical references (p. [576]-617) and index.
906 ## - LOCAL DATA ELEMENT F, LDF (RLIN)
a 7
b cbc
c origcop
d 3
e ncip
f 20
g y-gencatlg
Holdings
Withdrawn status Lost status Source of classification or shelving scheme Damaged status Not for loan Collection code Home library Location Shelving location Date of Cataloging Total Checkouts Full call number Barcode Checked out Date last seen Date checked out Price effective from Koha item type Public note
    Dewey Decimal Classification     Non-fiction CUTN Central Library CUTN Central Library Sciences 12/04/2018 1 530.411 MAR 31117 20/05/2020 20/05/2020 20/05/2020 12/04/2018 General Books Transferred to Dr.P.Ravindran
    Dewey Decimal Classification     Non-fiction CUTN Central Library CUTN Central Library Sciences 10/10/2018   530.411 MAR 33109   10/10/2018   10/10/2018 General Books