NSF REU SITE: Integrating Computation and Experiment to Create Revolutionary Materials

Possible projects for summer 2025
Faculty Mentor Possible Project(s)
Diego Gomez-Gualdron, PhD - Research and Technology Transfer

Diego Gomez-Gualdron

Project 1: Machine learning predictions metal organic framework synthesis

Project 2: Modeling of metal organic framework self assembly

halat_headshot_2023_edit David Halat

David Halat

Project 1: Solvation and transport in low-temperature Li-ion and Na-ion battery electrolytes through advanced NMR methods

Sam_cropped Samantha Johnson

Samantha Johnson

Project 1: Simulating Complex Solvation Environments for Ammonia Oxidation Catalysts

Project 2: Studying Complex Solvation Environments for Homogeneous Catalysts

Jihye Kim

Project 1: Unveiling the role of electrolyte chemistry on Co and Ni separation under pulsed electrodeposition

Project 2: Sustainable recycling of spent Li-ion battery cathodes using deep eutectic solvents

Annalise Maughan

Project 1: Understanding mixed ionic and electronic transport in lithium metal sulfides

Michael McGuirk

Project 1: Porous Noncovalent Frameworks

Project 2: Permanently Porous Chalcogen-Bonded Organic Frameworks

Aashutosh Mistry

Project 1: Probing Nucleation & Growth during Multivalent Electrodeposition

 

Eve Mozur

Project 1: Tracking Reactivity in Manganese Oxides for Battery Applications

Alex Pak

Project 1: Joint MD/ML approach for pyrenoid engineering

Project 2: Exploring sequence space for hierarchical protein complex design

Alan Sellinger

Alan Sellinger

Project 1: Amorphous organic scintillators for application in ionizing radiation detection 

Anna Staerz

Project 1: Siloxane interacting with FSP metal oxide sensors

Project 2: Low hydrogen detection using gas sensors operated in dielectric excitation mode

Eric Toberer

Project 1: Revealing local order in battery electrolytes through atomistic modeling

Project 2: Discovery of new frustrated magnetic materials

Some Final Posters from 2024