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MOLECULAR DYNAMICS

We develop and use molecular dynamics and related simulation methodologies,
especially those encompassed in our LAMMPS (Large-scale Atomic/Molecular
Massively Parallel Simulator) molecular simulation package
(https://www.lammps.org). LAMMPS is a freely available, widely used software
package that runs in serial or on high performance computing platforms, and
includes potentials for sold-state materials, soft matter, and coarse-grained or
mesoscopic systems.

Research Area: Molecular Dynamics

Related Projects
Hardware/Software Codesign for Exascale Computing
MapReduce-MPI
Contact
Littlewood, David John, djlittl@sandia.gov