README
9f4fdbbde86blammm-master-deprecated

README
View Options

			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. At the
			bottom of the doc page are many links to additional documentation
			contained in the doc/USER/atc directory.

			There are example scripts for using this package in examples/USER/atc.

			This package uses an external library in lib/atc which must be
			compiled before making LAMMPS. See the lib/atc/README file and the
			LAMMPS manual for information on building LAMMPS with external
			libraries. The settings in the Makefile.lammps file in that directory
			must be correct for LAMMPS to build correctly with this package
			installed.

			The primary people who created this package are Reese Jones
			(rjones at sandia.gov), Jeremy Templeton (jatempl at sandia.gov) and Jon
			Zimmerman (jzimmer at sandia.gov) at Sandia. Contact them directly if
			you have questions.