Limiting coordination calculation in RHEO

2024-10-01 10:01:12 -06:00
parent ec2fece8db
commit e3768f9ab0
6 changed files with 28 additions and 10 deletions
--- a/src/RHEO/compute_rheo_surface.cpp
+++ b/src/RHEO/compute_rheo_surface.cpp
@ -81,6 +81,8 @@ void ComputeRHEOSurface::init()
  threshold_splash = fix_rheo->zmin_splash;
  interface_flag = fix_rheo->interface_flag;

+  fix_rheo->coordination_flag = 1;
+
  cutsq = cut * cut;

  // need an occasional half neighbor list