dear lammps users,
I wrote output as .dcd or .xyz files and load them to VMD. However,
the VMD complained my output file and cannot load correctly. I have
attached the dump files and the lammps script below. Can anyone tell
me what's goes wrong?
thanks
haibin
# initialization Section
units metal
atom_style atomic
pair_style airebo 3.0 1 1
boundary f f p
read_data ${datafile}
pair_coeff * * /home/haibin/lammps/lammps-8Feb10/potentials/CH.airebo C
neighbor 2.0 bin
neigh_modify delay 5 check yes
timestep 0.0005
thermo_style custom step temp etotal pe ke
group cnt type = 1
thermo 100
thermo_modify lost ignore
dump 1 all dcd 10 dump.DCD
dump 2 cnt xyz 10 dump.xyz
#minimize 1.0e-7 0.0001 10000 100000
velocity cnt create 1600 87287
fix 1 cnt nvt 1273.15 1273.15 0.1
run 200
Haibin Chen Ph.D.
Mechanical Engineering Dept
Carnegie Mellon University
Pittsburgh, Pa, 15213
dump.DCD (387 KB)
dump.xyz (841 KB)