Universal Access To All Knowledge
Home donate | Forums | FAQs | Contributions | Terms, Privacy, & Copyright | Contact | Volunteer Positions | Jobs | Bios
Search: Advanced Search
Anonymous User (login or join us)
Upload
Search Results
Results: 1 through 1 of 1 (0.001 secs)
You searched for: subject:"thermodynamic ensembles"		Advanced search
[movies]3.320 Atomistic Computer Modeling of Materials, Spring 2005
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...
Keywords: simulation; computer simulation; atomistic computer simulations; Density-functional theory; DFT; Hartree-Fock; total-energy pseudopotential; thermodynamics; thermodynamic ensembles; quantum mechanics; first-principles; Monte Carlo sampling; molecular dynamics; finite temperature; Free energies; phase transitions; Coarse-graining; mesoscale model; nanotube; alloy
Downloads: 9,786
Sort results by:
> Relevance
Average rating
Download count
Date
Date added
Group results by:
> Relevance
Mediatype
Collection
Refine your search
File formats
MP3 files
Any audio file
Movie files
Images
Related collections
mit_ocw
Related creators
Related mediatypes
movies
Options
Turn off thumbnails
Show 'source' field

Terms of Use (10 Mar 2001)