31 citations · 52 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2020★ 21 cited
Machine learning formation enthalpies of intermetallics
Zhaohan Zhang, Mu Li, Katharine Flores +1
Developing fast and accurate methods to discover intermetallic compounds is relevant for alloy design. While density-functional-theory (DFT)-based methods have accelerated design o…
cond-mat.mtrl-sci2012★ 31 cited
Rapid Production of Accurate Embedded-Atom Method Potentials for Metal Alloys
Logan Ward, Anupriya Agrawal, Katharine M. Flores +1
The most critical limitation to the wide-scale use of classical molecular dynamics for alloy design is the availability of suitable interatomic potentials. In this work, we demonst…