adjust input according to new syntax

This commit is contained in:
Axel Kohlmeyer
2012-06-20 10:46:19 -04:00
parent 4441f9b5aa
commit a4fb2e6e1e

View File

@ -54,25 +54,25 @@ fix 1 all nve
thermo 1
run 0
read_dump dump.xyz 1 x y z format xyz box no
read_dump dump.xyz 1 x y z box no format xyz
run 0 pre yes post no
read_dump dump.melt 50 x y z format native box yes
read_dump dump.melt 50 x y z box yes format native
run 0 pre yes post no
rerun dump.xyz dump x y z format xyz box no
rerun dump.melt dump x y z format native box yes
read_dump dump.xyz 1 x y z format molfile box no reader xyz "."
rerun dump.xyz dump x y z box no format xyz
rerun dump.melt dump x y z box yes format native
read_dump dump.xyz 1 x y z box no format molfile xyz "."
run 0 pre yes post no
read_dump dump.melt 1 x y z format molfile box yes reader lammpstrj
read_dump dump.melt 1 x y z box yes format molfile lammpstrj
run 0 pre yes post no
rerun dump.xyz dump x y z format molfile box no reader xyz
rerun dump.dcd dump x y z format molfile box no reader dcd
rerun dump.xyz dump x y z box no format molfile xyz
rerun dump.dcd dump x y z box no format molfile dcd
read_dump dump-ele.xyz 1 x y z format xyz box no
read_dump dump-ele.xyz 1 x y z box no format xyz
run 0 pre yes post no
rerun dump-ele.xyz dump x y z format molfile box no reader xyz
rerun dump.dcd dump x y z format molfile box yes reader dcd
rerun dump-ele.xyz dump x y z box no format molfile xyz
rerun dump.dcd dump x y z box yes format molfile dcd
rerun dump.vels dump x y z vx vy vz format native box yes
rerun dump.vels dump x y z vx vy vz box yes format native
rerun dump.vels dump x y z vx vy vz format molfile box yes reader lammpstrj
rerun dump.vels dump x y z vx vy vz box yes format molfile lammpstrj