CoMD (https://github.com/ECP-copa/CoMD) is a MD benchmark similar to miniMD. It is developed at LANL.
In contrast to miniMD CoMD uses a simpler cell based approach to determine the nearby atoms in the force calculation.
Task is to integrate the basic algorithm of CoMD into MD-Bench.
CoMD (https://github.com/ECP-copa/CoMD) is a MD benchmark similar to miniMD. It is developed at LANL.
In contrast to miniMD CoMD uses a simpler cell based approach to determine the nearby atoms in the force calculation.
Task is to integrate the basic algorithm of CoMD into MD-Bench.