diff --git a/examples/README b/examples/README index 67aae4b3b7..43689dd27b 100644 --- a/examples/README +++ b/examples/README @@ -97,11 +97,19 @@ snap: NVE dynamics for BCC tantalum crystal using SNAP potential tad: temperature-accelerated dynamics of vacancy diffusion in bulk Si voronoi: test of Voronoi tesselation in compute voronoi/atom +Here is a src/Make.py command which will build a LAMMPS executable +"lmp_mpi" with all the packages needed by all the examples, with the +exception of the accelerate example. See the accelerate/README for +Make.py commands suitable for its example scripts. + +cd src +Make.py -p none std no-lib reax meam poems reaxc orig lib-all mpi + Here is how you might run and visualize one of the sample problems: cd indent -cp ../../src/lmp_linux . # copy LAMMPS executable to this dir -lmp_linux < in.indent # run the problem +cp ../../src/lmp_mpi . # copy LAMMPS executable to this dir +lmp_mpi < in.indent # run the problem Running the simulation produces the files {dump.indent} and {log.lammps}. You can visualize the dump file as follows: