21 citations · 26 across the 2 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2019★ 21 cited
Polarizable Potentials For Metals: The Density Readjusting Embedded Atom Method (DR-EAM)
Hemanta Bhattarai, Kathie E. Newman, J. Daniel Gezelter
In simulations of metallic interfaces, a critical aspect of metallic behavior is missing from the some of the most widely used classical molecular dynamics force fields. We present…
physics.chem-ph2016★ 5 cited
Real space electrostatics for multipoles. III. Dielectric Properties
Madan Lamichhane, Thomas Parsons, Kathie E. Newman +1
In the first two papers in this series, we developed new shifted potential (SP), gradient shifted force (GSF), and Taylor shifted force (TSF) real-space methods for multipole inter…
cond-mat.mes-hall2014
Theoretical Study of the Stability of Clusters
Danielle McDermott, Kathie E. Newman
We investigate the properties of clusters formed from two connected cage-like clusters, such as experimentally synthesized , using firs…