ASAP is a calculator for doing large-scale molecular dynamics (MD) within the Atomic Simulation Environment.
copied from cf-staging / asapASAP (Atomic SimulAtion Program or As Soon As Possible) is a package for large-scale molecular dynamics within the Atomic Simulation Environment (ASE). It implements a number of 'classical' potentials, most importantly the Effective Medium Theory, and also the mechanisms for domain-decomposition of the atoms.
