182 citations · 187 across the 4 of their papers we have counts for
5 papers
Quantitative Modelling of Solvation in 2D Materials via Alchemical Decoupling and Potential Energy Surfaces
Lindsey N. Ioos, Duncan A. Peterson, Scott C. Warren
Understanding why 2D materials remain suspended in solutions is essential to understanding the mechanisms of aggregation and exfoliation. These dynamics have been difficult to mode…
Efficient perturbations for basin hopping in amorphous glasses
Coraline Du, Hye Sol Kim, Scott C. Warren
Efficient exploration of the complex potential-energy landscapes of amorphous materials is central to computational structure discovery and refinement. Conventional Monte Carlo, re…
Synthesis and Electronic Structure of a Crystalline Stack of MXene Sheets
Daniel L. Druffel, Matthew G. Lanetti, Jack D. Sundberg +6
Despite the interest in MXenes in the last decade, all of the MXenes reported have a random mixture of surface terminations (-O, -OH, -F). In addition, restacked films have turbost…
Experimental Demonstration of an Electride as a 2D Material
Daniel L. Druffel, Kaci L. Kuntz, Adam H. Woomer +4
Because of their loosely bound electrons, electrides offer physical properties useful in chemical synthesis and electronics. For these applications and others, nano-sized electride…
Phosphorene: Synthesis, Scale-up, and Quantitative Optical Spectroscopy
Adam H. Woomer, Tyler W. Farnsworth, Jun Hu +3
Phosphorene, a two-dimensional (2D) monolayer of black phosphorus, has attracted considerable theoretical interest, although the experimental realization of monolayer, bilayer, and…