Presented By: Department of Mathematics
Student AIM Seminar
Beating the Curse with Density Functional Theory
The leading renewable energy sources suffer from inconsistent production levels. Solar panels don't generate power at night or during cloudy days and winds turbines rely on unpredictable weather. This is a major disadvantage compared to fossil fuels, which can be burned on demand. The answer is engineering better energy storage materials that will provide a buffer between the production and consumption.
Electronic structure, governed by the Schrodinger equation, is one of the key determinants of a material's energy storage performance. Oftentimes physical experiments are expensive, time consuming, or difficult to perform and must be complemented with numerical simulations. Question: how many bytes are required to store the wavefunction of a 10 electron system on a small 10x10x10 grid? Spoiler: way too many! In this talk I will present an alternative formulation of quantum mechanics called Density Functional Theory and discuss practical numerical methods for electronic structure simulations. Speaker(s): Nathan Vaughn (University of Michigan)
Electronic structure, governed by the Schrodinger equation, is one of the key determinants of a material's energy storage performance. Oftentimes physical experiments are expensive, time consuming, or difficult to perform and must be complemented with numerical simulations. Question: how many bytes are required to store the wavefunction of a 10 electron system on a small 10x10x10 grid? Spoiler: way too many! In this talk I will present an alternative formulation of quantum mechanics called Density Functional Theory and discuss practical numerical methods for electronic structure simulations. Speaker(s): Nathan Vaughn (University of Michigan)
Co-Sponsored By
Explore Similar Events
-
Loading Similar Events...