The files in this directory are a user-contributed package for LAMMPS.

The primary people who created these files are Reese Jones (rjones@sandia.gov), Jeremy Templeton (jatemple@sandia.gov) and Jon Zimmerman (jzimmer@sandia.gov). Contact them directly if you have questions.

This package implements a "fix atc" command which can be used in a LAMMPS input script. This fix can be employed to either do concurrent coupling of MD with FE-based physics surrogates or on-the-fly post-processing of atomic information to continuum fields. See the doc page for the fix atc command to get started.