Computational Materials Science and Process Simulation (CMP)

Modellbildung in der Partikeltechnik / Numerical Methods in Particle Technology [NMPT] Lecturer: Wolfgang Peukert Details: Vorlesung, 2 cred.h, ECTS: 4,5, nur Fachstudium Dates: Tue, 8:15 - 9:45, 0.154-115 Link to the StudOn page: - https://www.studon.fau.de/crs4409920.html Fields of study: PF MAP-S-CMP 2

Übung zu Modellbildung in der Partikeltechnik [NMPT-Ü] Lecturers: Tobias Schikarski, Nabi Traoré Details: Übung, 1 cred.h, für FAU Scientia Gaststudierende zugelassen, the first lecture will be on Tuesday 26th April 8:15 am Dates: Fri, 8:15 - 9:45, 0.157-115, KS I https://www.studon.fau.de/crs4409920.html Fields of study: PF MAP-S-CMP 2

Numerische Methoden in den Werkstoffwissenschaften - Atomistische Methoden [NumWW] Lecturer: Erik Bitzek Details: Vorlesung mit Übung, 4 cred.h, ECTS: 3, nur Fachstudium Dates: single appointment on 3.6.2022, 13:15 - 14:45, 1.84 single appointment on 3.6.2022, 15:00 - 18:00, 0.157-115 single appointment on 24.6.2022, 13:15 - 14:45, 1.84 single appointment on 24.6.2022, 15:00 - 18:00, 0.157-115 single appointment on 22.7.2022, 15:00 - 18:00, 0.157-115 single appointment on 22.7.2022, 13:15 - 14:45, 1.84 Vorbesprechung 06.05. 13:15-14:00 Uhr per zoom; For more information see studon: https://www.studon.fau.de/crs2202381.html Fields of study: PF MAP-S-CMP 2 Prerequisites / Organisational information: This lecture will be taught in English. Prerequisites: active account for the CIP Pool WW (available at the Geschäftsstelle WW) working knowledge of the Linux-operating system, will be examined in the first lecture. Contents: The aim of the course is to build the theoretical basis required to perform and analyze cutting-edge atomistic simulations in materials science, and to provide the students with a "computational toolbox” for the most common tasks in atomistic modeling. The focus of this course lies on direct hands-on teaching. The students will work on multiple little projects related to current research topics. This will enable the students to independently perform simulations using classical MD codes like IMD and QuantumEspresso for DFT calculations. Recommended literature: Tadmor, Miller, Modeling Materials: Continuum, Atomistic and Multiscale Techniques, Cambridge University Press (January 16, 2012) Further information on literature will be provided in the course. Keywords: Numerical Methods in Material Science