2 papers
cond-mat.mtrl-sci2019
Vicinal metal surfaces as potential catalysts for phosphorene epitaxial growth
Daniel Hashemi, Gene Siegel, Michael Snure +1
Phosphorene, a single layer of black phosphorous (BLK-P), has a significant potential for flexible and tunable electronics, but attempts to grow it epitaxially have been unsuccessf…
cond-mat.mtrl-sci2017
Predictive Simulations for Tuning Electronic and Optical Properties of SubPc Derivatives
Michael J. Waters, Daniel Hashemi, Guangsha Shi +2
Boron subphthalocyanine chloride is an electron donor material used in small molecule organic photovoltaics with an unusually large molecular dipole moment. Using first-principles…