tx258/lammps-gran-kokkos
1
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

change error-all to error-one

Browse Source
This commit is contained in:
oywg11
2019-04-06 10:26:56 +03:00
parent 6e6d350572
commit e629733d0b
2 changed files with 8 additions and 8 deletions
Download Patch File Download Diff File Expand all files Collapse all files

8
src/USER-MISC/pair_ilp_graphene_hbn.cpp
View File

@ -448,7 +448,7 @@ void PairILPGrapheneHBN::calc_normal()
// the magnitude of the normal vector
nn2 = n1[0]*n1[0] + n1[1]*n1[1] + n1[2]*n1[2];
nn = sqrt(nn2);
if (nn == 0) error->all(FLERR,"The magnitude of the normal vector is zero");
if (nn == 0) error->one(FLERR,"The magnitude of the normal vector is zero");
// the unit normal vector
normal[i][0] = n1[0]/nn;
normal[i][1] = n1[1]/nn;
@ -591,7 +591,7 @@ void PairILPGrapheneHBN::calc_normal()
// the magnitude of the normal vector
nn2 = n1[0]*n1[0] + n1[1]*n1[1] + n1[2]*n1[2];
nn = sqrt(nn2);
if (nn == 0) error->all(FLERR,"The magnitude of the normal vector is zero");
if (nn == 0) error->one(FLERR,"The magnitude of the normal vector is zero");
// the unit normal vector
normal[i][0] = n1[0]/nn;
normal[i][1] = n1[1]/nn;
@ -631,7 +631,7 @@ void PairILPGrapheneHBN::calc_normal()
}
}
else {
error->all(FLERR,"There are too many neighbors for calculating normals");
error->one(FLERR,"There are too many neighbors for calculating normals");
}
//##############################################################################################
@ -738,7 +738,7 @@ void PairILPGrapheneHBN::ILP_neigh()
ILP_firstneigh[i] = neighptr;
ILP_numneigh[i] = n;
if (n > 3) error->all(FLERR,"There are too many neighbors for some atoms, please check your configuration");
if (n > 3) error->one(FLERR,"There are too many neighbors for some atoms, please check your configuration");
ipage->vgot(n);
if (ipage->status())
error->one(FLERR,"Neighbor list overflow, boost neigh_modify one");

8
src/USER-MISC/pair_kolmogorov_crespi_full.cpp
View File

@ -446,7 +446,7 @@ void PairKolmogorovCrespiFull::calc_normal()
// the magnitude of the normal vector
nn2 = n1[0]*n1[0] + n1[1]*n1[1] + n1[2]*n1[2];
nn = sqrt(nn2);
if (nn == 0) error->all(FLERR,"The magnitude of the normal vector is zero");
if (nn == 0) error->one(FLERR,"The magnitude of the normal vector is zero");
// the unit normal vector
normal[i][0] = n1[0]/nn;
normal[i][1] = n1[1]/nn;
@ -594,7 +594,7 @@ void PairKolmogorovCrespiFull::calc_normal()
// the magnitude of the normal vector
nn2 = n1[0]*n1[0] + n1[1]*n1[1] + n1[2]*n1[2];
nn = sqrt(nn2);
if (nn == 0) error->all(FLERR,"The magnitude of the normal vector is zero");
if (nn == 0) error->one(FLERR,"The magnitude of the normal vector is zero");
// the unit normal vector
normal[i][0] = n1[0]/nn;
normal[i][1] = n1[1]/nn;
@ -634,7 +634,7 @@ void PairKolmogorovCrespiFull::calc_normal()
}
}
else {
error->all(FLERR,"There are too many neighbors for calculating normals");
error->one(FLERR,"There are too many neighbors for calculating normals");
}
//##############################################################################################
@ -742,7 +742,7 @@ void PairKolmogorovCrespiFull::KC_neigh()
KC_firstneigh[i] = neighptr;
KC_numneigh[i] = n;
if (n > 3) error->all(FLERR,"There are too many neighbors for some atoms, please check your configuration");
if (n > 3) error->one(FLERR,"There are too many neighbors for some atoms, please check your configuration");
ipage->vgot(n);
if (ipage->status())
error->one(FLERR,"Neighbor list overflow, boost neigh_modify one");