260028 VO Electronic Structure of Materials (2015S)
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Details
Sprache: Englisch
Prüfungstermine
Lehrende
Termine (iCal) - nächster Termin ist mit N markiert
Vorbesprechung: 04.03.15!
Eine Registrierung ist bis 30.06.15 23:00 Uhr möglich!
Mittwoch
04.03.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
11.03.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
18.03.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
25.03.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
15.04.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
22.04.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
29.04.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
06.05.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
13.05.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
20.05.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
27.05.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
03.06.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
10.06.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
17.06.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Mittwoch
24.06.
14:00 - 15:30
Seminarraum Physik Sensengasse 8 EG
Information
Ziele, Inhalte und Methode der Lehrveranstaltung
Art der Leistungskontrolle und erlaubte Hilfsmittel
Oral examination, possibly accompanied/replaced by a personal project consisting in the numerical solution of a problem.
Mindestanforderungen und Beurteilungsmaßstab
Computational quantum-mechanical modeling of materials. The lecture will give students the theoretical background and the practical experience to model, understand, and predict the properties of materials.
Prüfungsstoff
Slides - Blackboard - 'practical' computer examples
Literatur
Computational Physics, J.M. Thijssen (Cambridge University Press, 2007)
Electronic Structure: Basic Theory and Practical Methods, R. Martin (Cambridge University Press, 2004
Atomic and Electronic Structure of Solids, E. Kaxiras, Cambridge2003.
Electronic Structure: Basic Theory and Practical Methods, R. Martin (Cambridge University Press, 2004
Atomic and Electronic Structure of Solids, E. Kaxiras, Cambridge2003.
Zuordnung im Vorlesungsverzeichnis
MF 1, MF 9, MaG 7, MaG 8, MaG 23, MaG 24, MaV 1, MaV 6
Letzte Änderung: Mo 07.09.2020 15:40
the numerical solution of the many-electron Schrödinger equation and
provides an overview of electronic structure theory as applied to materials.
Specific topics include: Variational method and the many body problem;
Atoms; Wave function methods (Hartree-Fock and beyond); Density-functional theory; Band structure of crystal (Tight-binding method, full potential methods,
pseudopotentials); magnetism (Heisenberg Hamiltonian); selected examples of
properties of materials predicted from electronic structure schemes.
The applicability of the various computational tools to diverse problems will
be discussed (also through computational experiments involving the implementation of model HF and DFT programs). This course requires some basic knowledge of
quantum mechanics and solid states physics.