git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@152 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2006-11-13 22:49:27 +00:00
parent d03919e9f4
commit 518ae661f8
3 changed files with 13 additions and 17 deletions

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@ -33,10 +33,10 @@ region hi-half-sphere intersect 2 hi-asperity below-hi
# create 2 surfaces with asperities # create 2 surfaces with asperities
create_atoms 1 lo-slab create_atoms 1 region lo-slab
create_atoms 1 hi-slab create_atoms 1 region hi-slab
create_atoms 2 lo-half-sphere create_atoms 2 region lo-half-sphere
create_atoms 3 hi-half-sphere create_atoms 3 region hi-half-sphere
# LJ potentials # LJ potentials

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@ -8,10 +8,8 @@ lattice fcc 3.52
region box block 0 16.0 0 10.0 0 2.828427 region box block 0 16.0 0 10.0 0 2.828427
create_box 3 box create_box 3 box
orient x 1 0 0 lattice fcc 3.52 orient x 1 0 0 orient y 0 1 1 orient z 0 -1 1 &
orient y 0 1 1 origin 0.5 0 0
orient z 0 -1 1
origin 0.5 0 0
create_atoms 1 create_atoms 1
pair_style eam pair_style eam
@ -20,8 +18,8 @@ pair_coeff * * niu3.eam
neighbor 0.3 bin neighbor 0.3 bin
neigh_modify delay 5 neigh_modify delay 5
region lower block INF INF INF 1.4 INF INF region lower block INF INF INF 0.9 INF INF
region upper block INF INF 8.6 INF INF INF region upper block INF INF 6.1 INF INF INF
group lower region lower group lower region lower
group upper region upper group upper region upper
group boundary union lower upper group boundary union lower upper

View File

@ -8,10 +8,8 @@ lattice fcc 3.52
region box block 0 16.0 0 10.0 0 2.828427 region box block 0 16.0 0 10.0 0 2.828427
create_box 3 box create_box 3 box
orient x 1 0 0 lattice fcc 3.52 orient x 1 0 0 orient y 0 1 1 orient z 0 -1 1 &
orient y 0 1 1 origin 0.5 0 0
orient z 0 -1 1
origin 0.5 0 0
create_atoms 1 create_atoms 1
pair_style eam pair_style eam
@ -20,8 +18,8 @@ pair_coeff * * niu3.eam
neighbor 0.3 bin neighbor 0.3 bin
neigh_modify delay 5 neigh_modify delay 5
region lower block INF INF INF 1.4 INF INF region lower block INF INF INF 0.9 INF INF
region upper block INF INF 8.6 INF INF INF region upper block INF INF 6.1 INF INF INF
group lower region lower group lower region lower
group upper region upper group upper region upper
group boundary union lower upper group boundary union lower upper
@ -32,7 +30,7 @@ set upper atom 3
# void # void
region void cylinder z 8 5 2.5 INF INF region void cylinder z 8 3.535534 2.5 INF INF
delete_atoms region void delete_atoms region void
# temp controllers # temp controllers