Density functional theory : (Record no. 4011)
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| 000 -LEADER | |
|---|---|
| fixed length control field | 02308cam a2200385 a 4500 |
| 001 - CONTROL NUMBER | |
| control field | 15434796 |
| 003 - CONTROL NUMBER IDENTIFIER | |
| control field | NG-AbAUS |
| 005 - DATE AND TIME OF LATEST TRANSACTION | |
| control field | 20230307093525.0 |
| 008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION | |
| fixed length control field | 080902s2009 njua b 001 0 eng |
| 010 ## - | |
| -- | 2008038603 |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 9780470373170 (cloth) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 0470373172 (cloth) |
| 035 ## - | |
| -- | (OCoLC)ocn245025462 |
| 040 ## - CATALOGING SOURCE | |
| Original cataloging agency | DLC |
| Language of cataloging | eng |
| Transcribing agency | DLC |
| Modifying agency | BTCTA |
| -- | YDXCP |
| -- | OSU |
| -- | CDX |
| -- | C#P |
| -- | BWX |
| -- | HEBIS |
| -- | DEBBG |
| -- | UWW |
| -- | OCL |
| -- | EUM |
| -- | OCL |
| -- | DLC |
| 050 00 - | |
| -- | QC20.7.D43 |
| -- | S55 2009 |
| 082 00 - DEWEY DECIMAL CLASSIFICATION NUMBER | |
| Classification number | 530.14/4 |
| Edition number | 22 |
| 084 ## - | |
| -- | UL 2000 |
| -- | rvk |
| 084 ## - | |
| -- | VE 5650 |
| -- | rvk |
| 100 1# - MAIN ENTRY--PERSONAL NAME | |
| Personal name | Sholl, David S. |
| 9 (RLIN) | 461 |
| 245 10 - TITLE STATEMENT | |
| Title | Density functional theory : |
| Remainder of title | a practical introduction / |
| Statement of responsibility, etc | David S. Sholl, Janice A. Steckel. |
| 260 ## - PUBLICATION, DISTRIBUTION, ETC. (IMPRINT) | |
| Place of publication, distribution, etc | Hoboken, N.J. : |
| Name of publisher, distributor, etc | Wiley, |
| Date of publication, distribution, etc | c2009. |
| 300 ## - PHYSICAL DESCRIPTION | |
| Extent | xii, 238 p. : |
| Other physical details | ill. ; |
| Dimensions | 25 cm. |
| 504 ## - | |
| -- | Includes bibliographical references and index. |
| 505 0# - | |
| -- | What Is Density Functional Theory? -- DFT Calculations for Simple Solids -- Nuts and Bolts of DFT Calculations -- DFT Calculations for Surfaces of Solids -- DFT Calculations of Vibrational Frequencies -- Calculating Rates of Chemical Processes Using Transition State Theory -- Equilibrium Phase Diagrams from Ab Initio Thermodynamics -- Electronic Structure and Magnetic Properties -- Ab Initio Molecular Dynamics -- Accuracy and Methods beyond "Standard" Calculations. |
| 520 8# - | |
| -- | This work provides a brief, readable introduction to the key concepts and practical applications of DFT, at a level suitable for individuals who have never performed DFT calculations before. It includes worked examples and problems sets which will test the reader's ability to apply what they've learned. |
| 650 #0 - | |
| -- | Density functionals. |
| -- | 462 |
| 650 #0 - | |
| -- | Mathematical physics. |
| -- | 212 |
| 650 #0 - | |
| -- | Quantum chemistry. |
| -- | 463 |
| 700 1# - | |
| -- | Steckel, Janice A. |
| -- | 464 |
| 856 41 - | |
| -- | Table of contents only |
| -- | http://www.loc.gov/catdir/toc/ecip0827/2008038603.html |
| 856 41 - | |
| -- | Table of contents |
| -- | http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&doc_number=017557515&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA |
| 906 ## - | |
| -- | 7 |
| -- | cbc |
| -- | orignew |
| -- | 1 |
| -- | ecip |
| -- | 20 |
| -- | y-gencatlg |
| 942 ## - ADDED ENTRY ELEMENTS (KOHA) | |
| Source of classification or shelving scheme | Dewey Decimal Classification |
| Item type | Book |
| 955 ## - | |
| -- | jp00 2008-09-02 |
| -- | jp18 2008-09-02 |
| -- | aa07 2008-09-02 |
| -- | xe11 2010-05-04 1 copy rec'd., to CIP ver. |
| -- | xh00 2010-05-06 to USPL/STM |
| Withdrawn status | Lost status | Source of classification or shelving scheme | Damaged status | Not for loan | Home library | Current library | Shelving location | Date acquired | Source of acquisition | Total Checkouts | Full call number | Barcode | Date last seen | Copy number | Price effective from | Koha item type |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| African Development Bank Library (AfDBL) | African Development Bank Library (AfDBL) | General Stacks | 03/05/2019 | ADB Fund | QC20 .7. D43S55 2009 | 3456 | 09/25/2019 | 1 | 09/25/2019 | Book |