A practical introduction to modern molecular simulation techniques widely used as tools in chemical research. Classical molecular dynamics and Monte Carlo simulations methods are discussed. The necessary statistical mechanics required to understand and properly interpret the molecular simulations and link the results to measured bulk properties are introduced. An introduction to modern scientific computing environments and the Linux operating system is also provided. This course is equivalent to CHEM 5115 at Carleton University. Course Component: Lecture
A practical introduction to modern molecular simulation techniques widely used as tools in chemical research. Classical molecular dynamics and Monte Carlo simulations methods are discussed. The necessary statistical mechanics required to understand and properly interpret the molecular simulations and link the results to measured bulk properties are introduced. An introduction to modern scientific computing environments and the Linux operating system is also provided. This course is equivalent to CHEM 5115 at Carleton University. Course Component: Lecture
