Difference between revisions of "Ab Initio"
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;Required background: Quantum Mechanics | ;Required background: Quantum Mechanics | ||
== Literatur == | == Literatur == | ||
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| + | 1. {{Download|DFT.pdf|Short Introduction on Density Functional Function (DFT)}} | ||
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| + | 2. {{Download|DFT.pdf|Another Short Introduction on DFT}} | ||
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| + | 3. {{Download|DFT_book.pdf|A complete book on DFT}} | ||
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1. http://pages.unibas.ch/comphys/comphys/TEACH/SS09/course.pdf | 1. http://pages.unibas.ch/comphys/comphys/TEACH/SS09/course.pdf | ||
Revision as of 16:13, 22 July 2009
<setdata> date=t.b.a. topic=Ab Initio Methods speaker= tutor=Baofu Qiao </setdata>
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- Required background
- Quantum Mechanics
Literatur
1. 
Short Introduction on Density Functional Function (DFT) (431 KB)
2. Another Short Introduction on DFT (431 KB)
3. A complete book on DFT (file does not exist!)
1. http://pages.unibas.ch/comphys/comphys/TEACH/SS09/course.pdf
2. Modern Quantum Chemistry: Introduction to Advanced Electronic Structure Theory
Author: Attila Szabo and Attila Szabo
Publisher: Dover Publications (1996)
A Chemist’s Guide to Density Functional Theory. Second Edition
Wolfram Koch, Max C. Holthausen
Copyright © 2001 Wiley-VCH Verlag GmbH
ISBNs: 3-527-30372-3 (Softcover); 3-527-60004-3 (Electronic)
Gliederungsvorschlag
1. Density functional theory