Course: MIT 3.320 Atomistic Computer Modeling of Materials Dnatube
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Lec 1- MIT 3.320 Atomistic Computer Mode ...
Lec 1- MIT 3.320 Atomistic Computer Modeling of Materials. Introduction and Case Studies View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 2- MIT 3.320 Atomistic Computer Mode ...
Lec 2- MIT 3.320 Atomistic Computer Modeling of Materials. Potentials, Supercells, Relaxation, Methodology View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 3- MIT 3.320 Atomistic Computer Mode ...
Lec 3- MIT 3.320 Atomistic Computer Modeling of Materials. View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 4- MIT 3.320 Atomistic Computer Mode ...
Lec 4- MIT 3.320 Atomistic Computer Modeling of Materials. First Principles Energy Methods: The Many-Body Problem View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 5- MIT 3.320 Atomistic Computer Mode ...
Lec 5- MIT 3.320 Atomistic Computer Modeling of Materials. First Principles Energy Methods: Hartree-Fock and DFT View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 6- MIT 3.320 Atomistic Computer Mode ...
Lec 6- MIT 3.320 Atomistic Computer Modeling of Materials. Technical Aspects of Density Functional Theory View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 7- MIT 3.320 Atomistic Computer Mode ...
Lec 7- MIT 3.320 Atomistic Computer Modeling of Materials. Case Studies of DFT View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 8- MIT 3.320 Atomistic Computer Mode ...
Lec 8- MIT 3.320 Atomistic Computer Modeling of Materials. Advanced DFT: Success and Failure DFT Applications and Performance View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 9- MIT 3.320 Atomistic Computer Mode ...
Lec 9- MIT 3.320 Atomistic Computer Modeling of Materials. Finite Temperature: Review of Stat Mech and Thermodynamics Excitations in Materials and How to Sample Them View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 10- MIT 3.320 Atomistic Computer Mod ...
Lec 10- MIT 3.320 Atomistic Computer Modeling of Materials. Molecular Dynamics I View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 11- MIT 3.320 Atomistic Computer Mod ...
Lec 11- MIT 3.320 Atomistic Computer Modeling of Materials. Molecular Dynamics II View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 12- MIT 3.320 Atomistic Computer Mod ...
Lec 12- MIT 3.320 Atomistic Computer Modeling of Materials. Molecular Dynamics III: First Principles View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 13- MIT 3.320 Atomistic Computer Mod ...
Lec 13- MIT 3.320 Atomistic Computer Modeling of Materials. Monte Carlo Simulations: Application to Lattice Models, Sampling Errors, Metastability View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 14- MIT 3.320 Atomistic Computer Mod ...
Lec 14- MIT 3.320 Atomistic Computer Modeling of Materials. Monte Carlo Simulation II and Free Energies View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 15- MIT 3.320 Atomistic Computer Mod ...
Lec 15- MIT 3.320 Atomistic Computer Modeling of Materials. Free Energies and Physical Coarse-Graining View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 16- MIT 3.320 Atomistic Computer Mod ...
Lec 16- MIT 3.320 Atomistic Computer Modeling of Materials. Model Hamiltonions View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 17- MIT 3.320 Atomistic Computer Mod ...
Lec 17- MIT 3.320 Atomistic Computer Modeling of Materials. Ab-Initio Thermodynamics and Structure Prediction View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 18- MIT 3.320 Atomistic Computer Mod ...
Lec 18- MIT 3.320 Atomistic Computer Modeling of Materials. Accelerated Molecular Dynamics, Kinetic Monte Carlo, and Inhomogeneous Spatial Coarse Graining View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
Lec 19- MIT 3.320 Atomistic Computer Mod ...
Lec 19- MIT 3.320 Atomistic Computer Modeling of Materials. Case Studies: High Pressure Conclusions View the complete course at: http://ocw.mit.edu/3-320S05 License: Creative Commons BY-NC-SA More information at http://ocw.mit.edu/terms More courses at http://ocw.mit.edu
MIT 3.320 Atomistic Computer Modeling of Materials
Source of these courses is MIT
This course uses the theory and application of atomistic computer simulations to model, understand, and predict the properties of real materials. Specific topics include: energy models from classical potentials to first-principles approaches; density functional theory and the total-energy pseudopotential method; errors and accuracy of quantitative predictions: thermodynamic ensembles, Monte Carlo sampling and molecular dynamics simulations; free energy and phase transitions; fluctuations and tra
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COURSE NAME: MIT 3.320 Atomistic Computer Modeling of Materials