sPuReMD: move NaN checks on system energy to after logging. This allows better...
sPuReMD: move NaN checks on system energy to after logging. This allows better diagnostics for, e.g., the potential logging.
Showing
- sPuReMD/src/bond_orders.c 5 additions, 3 deletionssPuReMD/src/bond_orders.c
- sPuReMD/src/ffield.c 202 additions, 244 deletionssPuReMD/src/ffield.c
- sPuReMD/src/spuremd.c 5 additions, 0 deletionssPuReMD/src/spuremd.c
- sPuReMD/src/system_props.c 4 additions, 0 deletionssPuReMD/src/system_props.c
- sPuReMD/src/system_props.h 2 additions, 0 deletionssPuReMD/src/system_props.h
- sPuReMD/src/three_body_interactions.c 2 additions, 2 deletionssPuReMD/src/three_body_interactions.c
Loading
Please register or sign in to comment