Vorlesung Ankündigung 2017WS

Concepts of Molecular Modeling (222) ()

2017WS, Tuesdays 2. DS (09:20-10:50) Lecture in ZEU/114/H
Wednesdays 4. DS (13:00-14:30) Exercise Class in HSZ/403/H
Lab course: on appointments in

  First lecture: Tue 10.10.2017, 09:20

lecturer:G. Cuniberti
credits:Students of the Master Nanobiophysics
Physics students
Ph.D. students of the IMPRS Dynamical Processes in Atoms, Molecules and Solid
Students of the Master Organic and Molecular Electronics
summary:The course introduces methodologies to investigate the electronic and structural properties of a broad spectrum of physical systems. The course is accompanied by lab classes. The following topics will be discussed:
  • Adiabatic approximation
  • Normal modes
  • introduction to statistical mechanics
  • molecular dynamics
  • Monte Carlo simulations
  • introduction to electronic structure methods
  • lab classes
url:for ToC, literature, questions, comments etc. please visit the web site given below.