Dear All
I have ran following script with a serial version of LAMMPS on my laptop and I have got the results with no error, but when I ran it on a cluster system with a parallel version (open mpi) gives the following error.
ERROR: Label wasn't found in input script (input.cpp:160)
I think it relates to "jump SELF firstloop" command, that is different in windows and linux systems but I couldn't fix it.
I would be thankful if you let me know how could I fix it.
Thanks.
Reza
#### my script ####
dimension 3
boundary p p p
units metal
atom_style atomic
neighbor 2.0 nsq
neigh_modify delay 5
read_data data.txt
group All type 1 2
region Left block -3 25 -5 45 -70 70 units box
group Left region Left
region Right block 175 200 -5 45 -70 70 units box
group Right region Right
group Middle subtract All Left Right
group Boundary union Left Right
pair_style tersoff
pair_coeff * * BNC.tersoff N B
# ---------- Run Simulation ---------------------
variable myx equal -0.2
variable myy equal 0
variable myz equal 0
variable myvy equal 0
variable myvz equal 0
variable myx1 equal 0
variable myvx equal 0
variable a loop 40
dump 1 all custom 100 dump1.lammpstrj id type x y z
fix 3 Left setforce 0 0 0
fix 4 Right setforce 0 0 0
label firstloop
fix 11 Right move variable v_myx v_myy v_myz v_myvx v_myvy v_myvz
fix 12 Left move variable v_myx1 v_myy v_myz v_myvx v_myvy v_myvz
fix 1 Middle npt temp 300.0 300.0 100.0 iso 0.0 0.0 1000.0 drag 1.0
# ---------- Run Minimization ---------------------
thermo 100
thermo_style custom step pe lx ly lz
min_style cg
minimize 1e-25 1e-25 5000 10000
# ---------- Simulation ---------------------
timestep 0.001
thermo 50
thermo_style custom step pe lx ly lz
#dump 1 all xyz 100 [dump.xyz](http://dump.xyz)
run 10000
next a
jump SELF firstloop