7 citations · 14 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…
Breaking the mold: overcoming the time constraints of molecular dynamics on general-purpose hardware
Danny Perez, Aidan Thompson, Stan Moore +11
The evolution of molecular dynamics (MD) simulations has been intimately linked to that of computing hardware. For decades following the creation of MD, simulations have improved w…
Extreme Metastability of Diamond and its Transformation to BC8 Post-Diamond Phase of Carbon
Kien Nguyen-Cong, Jonathan T. Willman, Joseph M. Gonzalez +9
Diamond possesses exceptional physical properties due to its remarkably strong carbon-carbon bonding, leading to significant resilience to structural transformations at very high p…