17 citations · 22 across the 4 of their papers we have counts for
4 papers
Spatiotemporal spin transport from first principles
Mayada Fadel, Joshua Quinton, Mani Chandra +4
Manipulating spin for quantum information and spintronic devices requires quantitative prediction of quantum transport over long time and length scales. We introduce a computationa…
Magnetic-field dependence of spin-phonon relaxation and dephasing due to g-factor fluctuations from first principles
Joshua Quinton, Mayada Fadel, Junqing Xu +4
The electron spin decay lifetime in materials can be characterized by relaxation (T1) and irreversible (T2) and reversible (T2*) decoherence processes. Their interplay leads to a c…
BEAST DB: Grand-Canonical Database of Electrocatalyst Properties
Cooper Tezak, Jacob Clary, Sophie Gerits +12
We present BEAST DB, an open-source database comprised of ab initio electrochemical data computed using grand-canonical density functional theory in implicit solvent at consistent…
Bridging electronic and classical density-functional theory using universal machine-learned functional approximations
Michelle M. Kelley, Joshua Quinton, Kamron Fazel +3
The accuracy of density-functional theory (DFT) is determined by the quality of the approximate functionals, such as exchange-correlation in electronic DFT and the excess functiona…