Hi,
I am trying to simulate the following code, but when I entered dump command xyz(dump("dump*")).many()
It is showing that no dump file specified . Please tell me where it went wrong.
units real
dimension 2
boundary p s p
atom_style atomic
neighbor 2.0 bin
neigh_modify delay 5
# Create Geometry
region boundary block 0 100 0 80 -0.25 0.25 units box
create_box 3 boundary
mass 1 60.1
mass 2 60.1
mass 3 60.1
# Atom Regions
lattice hex 4.9
region sub_bot block INF INF INF 2 INF INF units box
region sub block INF INF INF 20 INF INF units box
lattice hex 4.9
region part sphere 50 50 0 30 units box
# Create Atoms
create_atoms 1 box
create_atoms 2 box
# LJ potentials
pair_style lj/cut 2.5
pair_coeff * * 0.3000 1.9123 4.78075
# Define Groups
group part region part
group sub_bot region sub_bot
group sub region sub
group mobile subtract all sub_bot
set group sub_bot type 3
# Initial velocities
compute newtemp mobile temp/partial 1 1 0
velocity mobile create 101 482748 units box
timestep 0.0001
thermo 5
thermo_modify temp newtemp
run 2000
# Fixes
fix 1 all enforce2d
fix 2 all nve
fix 3 sub_bot setforce 0.0 0.0 0.0
# fix 4 mobile temp/rescale 0.1 0.1 10 0.001 1
# dump 1 mobile atom 250 dump.sample
displace_atoms part move 0 -2.0 0 units box
# dump 2 mobile image 100 image.*.jpg type type1
timestep 0.01
thermo 50
thermo_modify temp newtemp
run 1000
ckloss | Mon, 10/21/2013 - 13:49
Are you trying to do this as
Are you trying to do this as a post-processing step or within the simulation?
Christoph