allocate extra_fields

2024-06-07 09:05:11 +02:00
parent 7cb73ca1a1
commit 001063250e
1 changed files with 4 additions and 2 deletions
--- a/lib/gpu/lal_dpd_charged.cpp
+++ b/lib/gpu/lal_dpd_charged.cpp
@ -70,10 +70,12 @@ int DPDChargedT::init(const int ntypes,
        }
  if (onetype<0) onetype=0;
  #endif
-
+  int extra_fields = 4; // round up to accomodate quadruples of numtyp values
+                        // q
  int success;
  success=this->init_atomic(nlocal,nall,max_nbors,maxspecial,cell_size,
-                            gpu_split,_screen,dpd_charged,"k_dpd_charged",onetype);
+                            gpu_split,_screen,dpd_charged,"k_dpd_charged",onetype, extra_fields);
+                            
  if (success!=0)
    return success;