Learning Outcomes |
PO |
MME |
The students who succeeded in this course: |
|
|
LO-1 |
Learned the Molecular Dynamics, interatomic potentials and packet programs |
PO-2 Comprehend interdisciplinary interactions and relations relevant to physics; analyze, compose, synthesize and evaluate new and complex ideas and to obtain original results by using expertise knowledge of the field PO-5 Research, understand, design, adopt and apply an original subject.
|
Examination Performance Project |
PO: Programme Outcomes MME:Method of measurement & Evaluation |
Course Contents |
The fundamentals of modeling and simulation, especially of atomic and molecular simulation methods are introduced, and programs of the methods used to introduce a few simple to use package. |
Weekly Course Content |
Week |
Subject |
Learning Activities and Teaching Methods |
1 |
Introduction of the scientific calculation |
Course lectures and presentation, aplication on computer |
2 |
Base of Molecular dynamic |
Course lectures and presentation, aplication on computer |
3 |
An example of Molecular Dynamic Code |
Course lectures and presentation, aplication on computer |
4 |
Neighbor lists |
Course lectures and presentation, aplication on computer |
5 |
Solving the equation of motion |
Course lectures and presentation, aplication on computer |
6 |
Calculation of interatomic forces |
Course lectures and presentation, aplication on computer |
7 |
Pair potantials |
Course lectures and presentation, aplication on computer |
8 |
mid-term exam |
|
9 |
Theory behind atomistic simulations |
Course lectures and presentation, aplication on computer |
10 |
Quantum mechanical methods |
Course lectures and presentation, aplication on computer |
11 |
Metallic potentials |
Course lectures and presentation, aplication on computer |
12 |
Potentials of other materials |
Course lectures and presentation, aplication on computer |
13 |
Other example programs in web |
Course lectures and presentation, aplication on computer |
14 |
Example application |
Course lectures and presentation, aplication on computer |
15 |
Example application |
Course lectures and presentation, aplication on computer |
16 |
final exam |
|
Recommend Course Book / Supplementary Book/Reading |
1 |
Ders Notları / Lecture Notes |
Required Course instruments and materials |
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