Merge branch 'master' into symbolic-atom-constants

This commit is contained in:
Axel Kohlmeyer
2020-09-15 17:44:31 -04:00
1186 changed files with 8448 additions and 8360 deletions

View File

@ -35,7 +35,7 @@ enum{TYPE,RADIUS};
ComputePropertyLocal::ComputePropertyLocal(LAMMPS *lmp, int narg, char **arg) :
Compute(lmp, narg, arg),
vlocal(NULL), alocal(NULL), indices(NULL), pack_choice(NULL)
vlocal(nullptr), alocal(nullptr), indices(nullptr), pack_choice(nullptr)
{
if (narg < 4) error->all(FLERR,"Illegal compute property/local command");
@ -254,8 +254,8 @@ ComputePropertyLocal::ComputePropertyLocal(LAMMPS *lmp, int narg, char **arg) :
error->all(FLERR,"Compute property/local requires atom attribute radius");
nmax = 0;
vlocal = NULL;
alocal = NULL;
vlocal = nullptr;
alocal = nullptr;
}
/* ---------------------------------------------------------------------- */
@ -273,7 +273,7 @@ ComputePropertyLocal::~ComputePropertyLocal()
void ComputePropertyLocal::init()
{
if (kindflag == NEIGH || kindflag == PAIR) {
if (force->pair == NULL)
if (force->pair == nullptr)
error->all(FLERR,"No pair style is defined for compute property/local");
if (force->pair->single_enable == 0)
error->all(FLERR,"Pair style does not support compute property/local");