Make some errors more elaborate + change some error->all to error->one

2019-04-03 18:12:12 +02:00
parent 799c16a8b2
commit f2f49e60bf
8 changed files with 28 additions and 39 deletions
--- a/src/USER-REAXC/pair_reaxc.cpp
+++ b/src/USER-REAXC/pair_reaxc.cpp
@ -431,6 +431,7 @@ void PairReaxC::setup( )
    int *num_hbonds = fix_reax->num_hbonds;

    control->vlist_cut = neighbor->cutneighmax;
+    control->me = comm->me;

    // determine the local and total capacity