Fix whitespace
This commit is contained in:
@ -396,7 +396,7 @@ void PairEAMAlloyGPU::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -405,10 +405,10 @@ void PairEAMAlloyGPU::read_file(char *filename)
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file->nr = values.next_int();
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file->dr = values.next_double();
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file->cut = values.next_double();
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nr + 1, "pair:rhor");
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@ -396,7 +396,7 @@ void PairEAMFSGPU::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -408,7 +408,7 @@ void PairEAMFSGPU::read_file(char *filename)
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nelements, file->nr + 1, "pair:rhor");
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@ -1010,7 +1010,7 @@ void PairEAMAlloyKokkos<DeviceType>::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -1019,10 +1019,10 @@ void PairEAMAlloyKokkos<DeviceType>::read_file(char *filename)
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file->nr = values.next_int();
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file->dr = values.next_double();
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file->cut = values.next_double();
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nr + 1, "pair:rhor");
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@ -568,7 +568,7 @@ void PairADP::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -580,7 +580,7 @@ void PairADP::read_file(char *filename)
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nr + 1, "pair:rhor");
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@ -488,7 +488,7 @@ void PairEAM::read_file(char *filename)
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->frho, (file->nrho+1), "pair:frho");
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memory->create(file->rhor, (file->nr+1), "pair:rhor");
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memory->create(file->zr, (file->nr+1), "pair:zr");
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@ -144,7 +144,7 @@ void PairEAMAlloy::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -153,10 +153,10 @@ void PairEAMAlloy::read_file(char *filename)
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file->nr = values.next_int();
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file->dr = values.next_double();
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file->cut = values.next_double();
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nr + 1, "pair:rhor");
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@ -144,7 +144,7 @@ void PairEAMFS::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -156,7 +156,7 @@ void PairEAMFS::read_file(char *filename)
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nelements, file->nr + 1, "pair:rhor");
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@ -144,7 +144,7 @@ void PairEAMAlloyIntel::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -153,10 +153,10 @@ void PairEAMAlloyIntel::read_file(char *filename)
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file->nr = values.next_int();
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file->dr = values.next_double();
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file->cut = values.next_double();
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nr + 1, "pair:rhor");
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@ -144,7 +144,7 @@ void PairEAMAlloyOMP::read_file(char *filename)
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strcpy(file->elements[i], word.c_str());
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}
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//
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//
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line = reader.next_line(5);
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values = ValueTokenizer(line);
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@ -153,10 +153,10 @@ void PairEAMAlloyOMP::read_file(char *filename)
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file->nr = values.next_int();
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file->dr = values.next_double();
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file->cut = values.next_double();
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if ((file->nrho <= 0) || (file->nr <= 0) || (file->dr <= 0.0))
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error->one(FLERR,"Invalid EAM potential file");
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memory->create(file->mass, file->nelements, "pair:mass");
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memory->create(file->frho, file->nelements, file->nrho + 1, "pair:frho");
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memory->create(file->rhor, file->nelements, file->nr + 1, "pair:rhor");
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@ -516,7 +516,7 @@ char *AtomVecHybrid::merge_fields(int inum, char *root,
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Tokenizer words(concat, " ");
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int nwords = words.count();
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int *unique = new int[nwords];
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for (int i = 0; i < nwords; i++) {
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