15 citations · 15 across the 1 of their papers we have counts for
2 papers
cond-mat.stat-mech2022★ 15 cited
A new framework for computing a general local self-diffusion coefficient using statistical mechanics
Michelle A. Hunter, Baris Demir, Charlotte F. Petersen +1
Widely applicable, modified Green-Kubo expressions for the local diffusion coefficient () are obtained using linear response theory. In contrast to past definitions in use, th…
cond-mat.mtrl-sci2019
Doping Effects on the Performance of Paired Metal Catalysts for the Hydrogen Evolution Reaction
Michelle A. Hunter, Julia M. T. A. Fischer, Marlies Hankel +2
Metal heteroatoms dispersed in nitrogen-doped graphene display promising catalytic activity for fuel cell reactions such as the hydrogen evolution reaction (HER). Here we explore t…