"Atomistic Modeling" 3 posts Sort by created date Sort by defined ordering View as a grid View as a list
This new course will give students hands-on experience with popular computational materials science and engineering software through a series of projects in: electronic structure calculation (e.g., VASP), molecular simulation (e.g., GROMACS), phase diagram modeling (e.g., Thermo-Calc), finite element modeling (e.g., OOF2), and materials selection. The course will familiarize students with a broad survey of software tools in computational materials science, scientific computing, and...
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Kuljit Virk onto Atomistic Modeling @ 7:48 pm on 11 Dec 2016
This set of ten presentations accompanied a graduate level course on Molecular Dynamics simulation. The specific objective of the course (and the presentations) is to provide: 1. Awareness of the opportunities and limitations of Molecular Dynamics as a tool for scientific and engineering research 2. Understanding of the compromise between model complexity/realism and computational expense 3. Background that enables interpretation of Molecular Dynamics-based studies reported in the literature
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Kuljit Virk onto Atomistic Modeling @ 7:29 pm on 11 Dec 2016
Fairly extensive set of lectures?
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Kuljit Virk onto Atomistic Modeling @ 7:24 pm on 11 Dec 2016
