verified cmake compatibility

2020-04-27 18:21:42 +02:00
parent 97ac67840b
commit 3ab797984b
2 changed files with 14 additions and 0 deletions
--- a/examples/USER/misc/pafi/in.pafi.lammps
+++ b/examples/USER/misc/pafi/in.pafi.lammps
@ -68,3 +68,16 @@ else &
 print """
 ----- END PAFI ----
 """
+
+
+
+#unfix hp
+#unfix pa
+#unfix af
+
+#minimize 0 0 1000 1000
+#print """
+#Full minimization post-run:
+#energy = ${pe} eV
+#"""
+