Introduction to Molecular Dynamics

By Alejandro Strachan

Purdue University

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Researchers should cite this work as follows:

  • Alejandro Strachan (2015), "Introduction to Molecular Dynamics," https://nanohub.org/resources/22694.

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Discovery Learning Center, Room 131, Purdue University, West Lafayette, IN

Tags

  1. molecular dynamics (MD)
Introduction to Molecular Dynamics
  • Introduction to molecular dynamics 1. Introduction to molecular dyna… 0
    00:00/00:00
  • Predictive science & materials modeling 2. Predictive science & materials… 183.0830830830831
    00:00/00:00
  • Materials are everywhere 3. Materials are everywhere 444.44444444444446
    00:00/00:00
  • Molecular materials 4. Molecular materials 880.38038038038042
    00:00/00:00
  • Fundamental theory 5. Fundamental theory 951.88521855188526
    00:00/00:00
  • Predictive simulations 6. Predictive simulations 1054.6546546546547
    00:00/00:00
  • Basic physics & approximations 7. Basic physics & approximations 1152.8862195528864
    00:00/00:00
  • Electronic and atomic processes 8. Electronic and atomic processe… 1308.7087087087089
    00:00/00:00
  • Molecular dynamics 9. Molecular dynamics 1612.4791458124792
    00:00/00:00
  • So … what is MD? 10. So … what is MD? 1734.1341341341342
    00:00/00:00
  • Predicting the future with MD 11. Predicting the future with MD 1744.477811144478
    00:00/00:00
  • Simple MD simulations 12. Simple MD simulations 1881.4481147814481
    00:00/00:00
  • Nanoelectronics: electrometallization cells 13. Nanoelectronics: electrometall… 2440.5071738405072
    00:00/00:00
  • Nano-engineering to control thermal transport 14. Nano-engineering to control th… 2561.6282949616284
    00:00/00:00
  • Role of size and interfaces 15. Role of size and interfaces 2565.0984317650987
    00:00/00:00
  • Thermal transport at the nanoscale 16. Thermal transport at the nanos… 2597.6309642976312
    00:00/00:00
  • Nano-engineering for mechanical response 17. Nano-engineering for mechanica… 2600
    00:00/00:00
  • Engineering curvature in graphene 18. Engineering curvature in graph… 2608.1748415081747
    00:00/00:00
  • Nano-engineering energetic materials 19. Nano-engineering energetic mat… 2618.3516850183519
    00:00/00:00
  • Nanostructure role on chemical reactions 20. Nanostructure role on chemical… 2618.9856523189856
    00:00/00:00
  • Reactions in bulk nanolaminates 21. Reactions in bulk nanolaminate… 2624.3576910243578
    00:00/00:00
  • Role of extended defects 22. Role of extended defects 2712.645979312646
    00:00/00:00
  • Role of extended free-volume defects 23. Role of extended free-volume d… 2715.0483817150484
    00:00/00:00
  • Polymer composite projects 24. Polymer composite projects 2715.7490824157494
    00:00/00:00
  • Molecular structure of thermoset polymers 25. Molecular structure of thermos… 2716.6166166166167
    00:00/00:00
  • Properties vs. conversion degree 26. Properties vs. conversion degr… 2717.2839506172841
    00:00/00:00
  • Rate effects in polymer properties 27. Rate effects in polymer proper… 2718.5518852185519
    00:00/00:00
  • Processing and properties of thin films 28. Processing and properties of t… 2719.1191191191192
    00:00/00:00
  • Polymer/graphite nanocomposites 29. Polymer/graphite nanocomposite… 2719.9532866199534
    00:00/00:00
  • Multiscale, multiphysics w/ quantified uncertainties 30. Multiscale, multiphysics w/ qu… 2725.2585919252588
    00:00/00:00
  • Uncertainty propagation 31. Uncertainty propagation 2996.4297630964297
    00:00/00:00
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