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README |
README
This directory contains libraries that can be linked with when building LAMMPS. The library itself must be built first, so that a lib*.a file exists for LAMMPS to link against. Each library directory contains a README with additional info. You will need to copy one of the Makefile.* files to Makefile before building a library. If a Makefile.* suitable for your machine does not exist, you will need to edit one of the existing Makefiles. The libraries included in the LAMMPS distribution are the following: atc atomistic-to-continuum methods from Reese Jones, Jeremy Templeton, Jon Zimmerman (Sandia) gpu graphical processor (GPU) routines, currently NVIDIA specific, from Mike Brown (Sandia) poems POEMS rigid-body integration package from RPI meam modified embedded atom method (MEAM) potential from Greg Wagner (Sandia) reax ReaxFF potential from Adri van Duin (Penn State) and Aidan Thompson (Sandia)