Added atom map into example, enforce atom map added to fix_numdiff, added error statement to fix_numdiff.h

2020-03-09 10:33:04 -06:00
parent 606eaf61f7
commit 903e33d86e
3 changed files with 8 additions and 0 deletions
--- a/examples/numdiff/in.numdiff
+++ b/examples/numdiff/in.numdiff
@ -3,6 +3,7 @@
 units   	metal
 atom_style      atomic

+atom_modify map yes
 lattice fcc 5.358000
 region box block 0 6 0 6 0 6
 create_box 1 box