Publications

Gui, X.; Auer, A. A. Electronic Structure Simulations of the Platinum/Support/Ionomer Interface in Proton Exchange Membrane Fuel Cells. Fuel Cells: from Fundamentals to Systems 2025, 25, e202400117.

Feliciano, G. T.; Auer, A. A. Toward Explicit Solvation for Simulations of Electrocatalytic Reactions: AIMD for PKa and Redox Potentials of Transition Metal Compounds and Catalyst Models. The Journal of Physical Chemistry A 2025, 129, 1757–1768.