Ab Initio

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<setdata> date=t.b.a. topic=Ab Initio Methods speaker= tutor=Baofu Qiao </setdata>

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Quantum Mechanics


1. application_pdf.pngShort Introduction on Density Functional Function (DFT) (431 KB)Info circle.png

2. application_pdf.pngAnother Short Introduction on DFT (171 KB)Info circle.png

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)

3. http://kolho3.tiera.ru/Ch_Chemistry/Koch%20W.,%20Holthausen%20M.%20A%20Chemist%23s%20Guide%20to%20Density%20Functional%20Theory%20(2ed.,%20Wiley,%202001)(306s).pdf

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)


1. Density functional theory