48 citations · 48 across the 4 of their papers we have counts for
5 papers · 1 filter
Simulations of Disordered Matter in 3D with the Morphological Autoregressive Protocol (MAP) and Convolutional Neural Networks
Ata Madanchi, Michael Kilgour, Frederik Zysk +2
Disordered molecular systems such as amorphous catalysts, organic thin films, electrolyte solutions, and water are at the cutting edge of computational exploration today. Tradition…
Electronic Conduction Through Monolayer Amorphous Carbon Nano-Junctions
Nicolas Gastellu, Michael Kilgour, Lena Simine
In molecular electronic conduction, exotic lattice morphologies often give rise to exotic behaviors. Among 2D systems, graphene is a notable example. Recently, a stable amorphous v…
Coherence and decoherence in quantum absorption refrigerators
Michael Kilgour, Dvira Segal
Absorption refrigerators transfer thermal energy from a cold reservoir to a hot reservoir using input energy from a third, so-called work reservoir. We examine the operation of qua…
Thermopower of molecular junctions: Tunneling to hopping crossover in DNA
Roman Korol, Michael Kilgour, Dvira Segal
We study the electrical conductance and the thermopower of single-molecule junctions, and reveal signatures of different transport mechanisms: off-resonant tunneling, on-re…
Intermediate coherent-incoherent charge transport: DNA as a case study
Hyehwang Kim, Michael Kilgour, Dvira Segal
We study an intermediate quantum coherent-incoherent charge transport mechanism in metal-molecule-metal junctions using Büttiker's probe technique. This tool allows us to include i…