Principal Investigator
Principal Investigator
gezelter@nd.edu
Graduate Students
- Simulations of ionic conductivity in liquids
- Developement of new reverse non-equilibrium molecular dynamics (RNEMD) methods

Anderson Duraes
- Vortex separation of enantiomers
- Reverse non-equilibrium molecular dynamics (RNEMD)
- Density Readjusting Embedded Atom Method (DR-EAM) for metal oxides and mixed metal / metal oxide surfaces
- Structure and Dynamics of water around the anti-freeze protein DAFP1
- Binding energetics of DAFP1 to ice facets
- Simulations of thermal transport from polarizable metal nanoparticles
Undergraduate Students
Previous Members
Postdoctoral Researchers
Undergraduate Students
Heather Chiarello
Dan Combest
Patrick Conforti
Peter DeCarlo
Kenneth Fletcher
Skyler Hamilton
Erik Helgesen
Soren Holm
Andrew Latham
Patrick Holvey
Patrick McIntyre
Nicholas Milikich
Fabely Moreno
Jennifer Morton
Thomas Parsons
Chelsea Popoola
Christie Puglis
Jasmine Sindelar
Megan Sprague
Jenna Stevens
High School Students
Andrew Kaboski