SURF 2023 Presentations:
Rayal Smith (LSAMP 2023): Data-Enabled Computational Chemistry to Better Understand Water Quality
Jeanne Ngo and Caitlin Doherty (Baltimore SCIART 2023): Nitrates and Phosphates of the Surface of Calcite
Joshua Birenzvige (Baltimore SCIART 2023): Sulfates on Calcite Using Density Functional Theory
Rachal Rehling (Baltimore SCIART 2023): Chlorides on Calcite Surfaces
SURF 2022 Presentations:
Computational Team: Lilly Kidd, Aria Tauraso, Amalthea Trobare
A Noninvasive Computational Investigation of the Photodegradation of Vermillion
URCAD 2022 Presentations:
Aaliyah Khan
Computational Discovery of New Functional Materials for Energy Generation and Storage
URCAD 2021 Presentations:
Josh Leginze
“Use of Density Functional Theory and First-Principles Thermodynamics in Understanding Lead Oxide Surface Transformations”
Autumn Cook
“Discovering and Characterizing New Functional Ferroelectric and Antiferroelectric Materials Using Computers”
Aaliyah Khan
“Systematic Route To Explore the Potential Energy Landscape of A New Family of Functional Materials”
Spring 2020 meeting of the American Chemical Society (cancelled)
“Combining Database Mining and DFT to Create New Materials” is available online:
https://doi.org/10.1021/scimeetings.0c02486