small changes- still not compiling on Windows...

2023-01-12 21:24:40 +01:00
parent bdf6cdd327
commit c8f380ffbb
2 changed files with 2 additions and 2 deletions
--- a/src/REPLICA/fix_neb.cpp
+++ b/src/REPLICA/fix_neb.cpp
@ -61,7 +61,7 @@ FixNEB::FixNEB(LAMMPS *lmp, int narg, char **arg) :

  // optional params

-  neb_mode = 0;
+  neb_mode = NEIGHBOR; // default setting
  PerpSpring = FreeEndIni = FreeEndFinal = false;
  FreeEndFinalWithRespToEIni = FinalAndInterWithRespToEIni = false;
  kspringPerp = 0.0;