git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@646 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2007-06-22 23:46:37 +00:00
parent b704a82daf
commit e3fa1c4ef6
42 changed files with 159 additions and 6082 deletions
--- a/examples/nemd/in.nemd
+++ b/examples/nemd/in.nemd
@ -0,0 +1,31 @@
+# 2d NEMD simulation
+
+units		lj
+atom_style	atomic
+dimension	2d
+
+lattice		sq2 0.8442
+region		box prism 0 10 0 8 -0.5 0.5 0 0 0
+create_box	2 box
+create_atoms	1 box
+mass		* 1.0
+
+velocity	all create 1.44 87287 loop geom
+
+region		slice block 4 6 INF INF INF INF
+set		region slice type 2
+
+pair_style	lj/cut 2.5
+pair_coeff	* * 1.0 1.0 1.0
+
+neighbor	0.3 bin
+neigh_modify	delay 0 every 1
+
+fix		1 all nvt/sllod 1.0 1.0 1.0 
+fix		2 all deform 1 xy erate 0.01 remap v
+
+dump		1 all custom 500 dump.nemd tag type x y z
+
+thermo		1000
+
+run		50000