7 citations · 11 across the 3 of their papers we have counts for
3 papers
LAMMPS-KOKKOS: Performance Portable Molecular Dynamics Across Exascale Architectures
Anders Johansson, Evan Weinberg, Christian R. Trott +2
Since its inception in 1995, LAMMPS has grown to be a world-class molecular dynamics code, with thousands of users, over one million lines of code, and multi-scale simulation capab…
Harnessing Machine Learning for Quantum-Accurate Predictions of Non-Equilibrium Behavior in 2D Materials
Yue Zhang, Robert J. Appleton, Kui Lin +5
Accurately predicting the non-equilibrium mechanical properties of two-dimensional (2D) materials is essential for understanding their deformation, thermo-mechanical properties, an…
Atomic Representations of Local and Global Chemistry in Complex Alloys
Megan J. McCarthy, Jacob Startt, Rémi Dingreville +2
The exceptional properties observed in complex concentrated alloys (CCAs) arise from the interplay between crystalline order and chemical disorder at the atomic scale, complicating…