2 papers
cond-mat.soft2026
Relating solute interactions to interfacial properties
Varun Mandalaparthy, Benjamin M. Curlee, William G. Noid
Liquid interfaces are both ubiquitous and also critically important for many commercial products, modern technologies, biological processes, and environmental phenomena. The proper…
physics.chem-ph2026
A Perspective on Phase Space Electronic Structure Theory : From Its Surface Hopping Origins Through To Its Future Promise
Joseph E. Subotnik, Ethan Alguire, Nicole Bellonzi +20
We trace the history of phase space electronic structure theory (PSEST), high- lighting how this powerful approach emerged from fundamental questions in semi- classical surface hop…