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Computational Engineering (Rechnergestütztes Ingenieurwesen) (Master of Science) >>

Numerische Methoden in den Werkstoffwissenschaften - Atomistische Methoden (NumWW)

Lecturer

Prof. Dr.-Ing. Erik Bitzek

Details

Vorlesung mit Übung
2 cred.h, ECTS studies, ECTS credits: 3
nur Fachstudium, Sprache Englisch
Time and place: Fri 16:15 - 17:45, CIP Pool WW; comments on time and place: Beginn: 26.04.2019

Fields of study

WPF MWT-MA-AWE ab 1 (ECTS-Credits: 3)
PF MWT-MA-WSI 2 (ECTS-Credits: 3)
WPF MWT-MA-MNF ab 1 (ECTS-Credits: 3)
PF MAP-S-CMP 2 (ECTS-Credits: 3)
WF CE-MA-TA-CMS 2 (ECTS-Credits: 3)

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.

ECTS information:

Credits: 3

Additional information

Expected participants: 90

Verwendung in folgenden UnivIS-Modulen

Startsemester WS 2018/2019:: Advanced Materials Simulation (CE_AdvMatSci); Kernfach Mikro- und Nanostrukturforschung für MWT (MNF_M1_MWT); Kernfach Mikro- und Nanostrukturforschung für NT (MNF_M6_NT); Kernfach Werkstoffsimulation (COMM); Kernfachmodul Allgemeine Werkstoffeigenschaften (M1-MWT-WW1/M6-NT-WW1); Multiscale Materials Simulation (CE_MuSim); Werkstoffsimulation (M2/M3) (COMM)
Startsemester SS 2019:: Schwerpunktfach Computational Material Science and Process Simulation (Compu focal)

Department: Chair of General Materials Properties



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