165.144 Simulations of solids
This course is in all assigned curricula part of the STEOP.
This course is in at least 1 assigned curriculum part of the STEOP.

2019W, VU, 2.0h, 3.0EC, to be held in blocked form

Properties

  • Semester hours: 2.0
  • Credits: 3.0
  • Type: VU Lecture and Exercise

Learning outcomes

After successful completion of the course, students are able to...

  • understand lattice vibrations in solids
  • describe magnetism and relativistic effects
  • use and operate quantummechanical calculations for solids

Subject of course

Quantum mechanical methods for solids and surfaces Structure optimization, DFT, Phonons and finite temperature, Magnetism and relativistic effects, Quantum mechanical simulations of materials properties and their interpretations Relations between crystal structure and physical/chemical properties

Teaching methods

  • Lecture about foundations of solid state theory, DFT, Magnetism, Lattice vibrations
  • Operate exercises on a PC

Mode of examination

Oral

Additional information

! For data protection purposes we can only respond to enquiries sent from an official TU (student) e-mail address !

Lecturers

Institute

Course dates

DayTimeDateLocationDescription
Mon14:00 - 14:3007.10.2019 Seminarraum Theoretische Chemie, BA 01 56AVorbesprechung
Mon14:00 - 15:3014.10.2019 - 03.02.2020 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Simulations of solids - Single appointments
DayDateTimeLocationDescription
Mon07.10.201914:00 - 14:30 Seminarraum Theoretische Chemie, BA 01 56AVorbesprechung
Mon14.10.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon21.10.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon28.10.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon04.11.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon11.11.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon18.11.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon25.11.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon02.12.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon09.12.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon16.12.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon23.12.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon30.12.201914:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon06.01.202014:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon13.01.202014:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon20.01.202014:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon27.01.202014:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Mon03.02.202014:00 - 15:30 Seminarraum Theoretische Chemie, BA01 56A (right)Lecture
Course is held blocked

Examination modalities

  • Oral exam
  • Answer a questionair related to the practical exercises

Course registration

Not necessary

Curricula

Literature

No lecture notes are available.

Previous knowledge

Theoretical Chemistry

Preceding courses

Language

if required in English