MIT 3.320 Atomistic Computer Modeling of Materials
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Lec 1 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 15,216 views
Introduction and Case Studies
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Lec 2 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 7,245 views
Potentials, Supercells, Relaxation, Methodology
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Lec 3 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 4,434 views
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Lec 5 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 4,758 views
First Principles Energy Methods: The Many-Body Problem
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Lec 6 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 5,293 views
First Principles Energy Methods: Hartree-Fock and DFT
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Lec 7 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 6,632 views
Technical Aspects of Density Functional Theory
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Lec 8 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 3,075 views
Case Studies of DFT
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Lec 9 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 2,283 views
Advanced DFT: Success and Failure
DFT Applications and Performance
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Lec 11 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 1,989 views
Finite Temperature: Review of Stat Mech and Thermodynamics
Excitations in Materials and How to Sample Them
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Lec 13 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 3,911 views
Molecular Dynamics I
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Lec 14 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 1,932 views
Molecular Dynamics II
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Lec 15 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 2,106 views
Molecular Dynamics III: First Principles
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Lec 17 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 2,602 views
Monte Carlo Simulations: Application to Lattice Models, Sampling Errors, Metastability
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Lec 18 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 2,382 views
Monte Carlo Simulation II and Free Energies
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Lec 19 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 1,583 views
Free Energies and Physical Coarse-Graining
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Lec 20 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 1,281 views
Model Hamiltonions
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Lec 22 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 2,496 views
Ab-Initio Thermodynamics and Structure Prediction
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Lec 23 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 2,375 views
Accelerated Molecular Dynamics, Kinetic Monte Carlo, and Inhomogeneous Spatial Coarse Graining
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Lec 25 | MIT 3.320 Atomistic Computer Modeling of Materials
by MIT 1,548 views
Case Studies: High Pressure
Conclusions
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