A chemist's guide to density functional theory / Wolfram Koch, Max C. Holthausen.
Material type:
TextPublisher: Weinheim : Wiley-VCH, 2002Edition: Second edition; Reprinted editionDescription: xiii, 294 pages : illustrations ; 25 cmContent type: - text
- unmediated
- volume
- 3527303723 (pbk.)
- 9783627303723
- 541.28 KOC 22
| Cover image | Item type | Current library | Home library | Collection | Shelving location | Call number | Materials specified | Vol info | URL | Copy number | Status | Notes | Date due | Barcode | Item holds | Item hold queue priority | Course reserves | |
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Book - Borrowing
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Central Library First floor | Baccah | 541.28 KOC (Browse shelf(Opens below)) | Available | 000048991 |
Includes bibliographical references and index.
Many use Density Functional Theory (DFT) programs as black-box tools without having a quantum theoretical background or a concise knowledge about the strength and weaknesses of this approach. This text is designed to bridge the gap and to guide the non-expert user.
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