Foundations of Computational Materials Modelling free videos and free material uploaded by IIT Madras Staff .
Week 1 : Introduction to Computational Modeling
Week 2 : Introduction to Crystals
Week 3 : Symmetry in Crystals
Week 4 : Plane GroupsWeek 5 : Space Groups
Week 6 : Construction of 2D and 3D crystals in MATLAB
Week 7 : Statistical Mechanics
Week 8 : Statistical Mechanics
Week 9 : Introduction to Molecular DynamicsWeek 10 : Molecular dynamics using LAMMPS – 1
Week 11 : Molecular dynamics using LAMMPS -2
Week 12 : Molecular dynamics using LAMMPS -3 and Closure
Thanks to the support from MathWorks, enrolled students have access to MATLAB for the duration of the course.
This course provides the necessary foundations to (a) build computational samples of crystals (b) Introduce statistical mechanics and its connection to Molecular dynamics (c) Provide enough ground in Molecular dynamics using LAMMPSINTENDED AUDIENCE : All Engineering studentsPREREQUISITES :Basic Materials Science Course at the undergraduate level, MATLAB programming, familiarity with LINUX is preferred.INDUSTRY SUPPORT : None. This course will be useful for students pursuing research requiring molecular simulations of solids.
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