airebo

Dear LAMMPS Users,

I am Manish,an undergraduate from India.
I have defined a hybrid pair_style as follows:

pair_style hybrid airebo 1.7 1 0 eam lj/cut 5.0
pair_coeff * * airebo CH.airebo C NULL
pair_coeff 2 2 eam Cu_u3.eam
pair_coeff 1 2 lj/cut 0.01 3.0 7.00

When I run the program, it does not show any error but it stops after the setting up Verlet Run i.e like this:

[email protected]…6219…:~/lammps/examples/dewetting_new$ mpirun -np 4 ~/lammps/src/lmp_mpi < Dewetting_NEW_6.in
LAMMPS (14 May 2016)
Created orthogonal box = (0 0 0) to (100 100 50)
2 by 2 by 1 MPI processor grid
Lattice spacing in x,y,z = 2.462 1 6.7079
Created 20300 atoms
20300 atoms in group subs
Lattice spacing in x,y,z = 3.597 3.597 3.597
0 atoms in group addatoms
Reading potential file CH.airebo with DATE: 2011-10-25
Reading potential file Cu_u3.eam with DATE: 2007-06-11
5800 atoms in group mobile
WARNING: One or more atoms are time integrated more than once (…/modify.cpp:266)
Neighbor list info …
5 neighbor list requests
update every 1 steps, delay 0 steps, check yes
max neighbors/atom: 100000, page size: 10000000
master list distance cutoff = 9.81637
ghost atom cutoff = 9.81637
binsize = 4.90819, bins = 21 21 11
Setting up Verlet run …
Unit style : metal
Current step: 0
Time step : 1e-05

I have given it almost 24 hours still the program does not move forward.However, if i remove airebo & use Lj The program just works fine.
Any help would be very helpful.Thanks in Advance

this warning indicates, that there is something *very* wrong in your input.

axel.