27 lines
576 B
Plaintext
27 lines
576 B
Plaintext
|
|
variable pstyle index lj_cut_coul_cut-01 lj_cut_coul_cut-02 lj_cut_coul_cut-03 &
|
|
lj_cut_coul_cut-04 lj_cut_coul_cut-05 lj_cut_coul_cut-06
|
|
label pstyle
|
|
|
|
#############################################################
|
|
|
|
variable astyle index charge full
|
|
label astyle
|
|
|
|
variable sbonds index "lj/coul 1.0 1.0 1.0" "lj/coul 0.5 0.5 0.5" &
|
|
"lj/coul 0.0 0.0 0.0" "lj 0.0 0.0 0.0" "lj 0.5 0.5 0.5" &
|
|
"coul 0.0 0.0 0.0" "coul 0.5 0.5 0.5"
|
|
label sbonds
|
|
|
|
include common-1.inc
|
|
|
|
next sbonds
|
|
jump SELF sbonds
|
|
|
|
next astyle
|
|
jump SELF astyle
|
|
|
|
next pstyle
|
|
jump SELF pstyle
|
|
|