[lammps-users] reax/c invalid pair_style

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1

Hi,

I compiled the latest version of lammps. Everything went ok, except that when I run the in.reax_c.rdx and in.reax_c.tatb in the example dir the program respoded:

ERROR: Invalid pair style

running in.reax.rdx and in.reax.tatb is OK though.

the steps I did the compilation are:

make yes-reax # (in src)
make -f Makefile.ifort # (in lib/reax)
make openmpi # (in src)

Help needed! Thanks!

2

Xiao, the examples you're trying to run require you to have the C version of reaxFF installed as a user package, i.e.

make yes-user-reaxc
make openmpi

I suggest you read the online documentation for further details http://lammps.sandia.gov/doc/pair_reax_c.html

Andres

P.D. You compiled the fortran version for which there are equivalent rdx/tatb examples in the same dir