ICODE-ADC/lammps
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implement clang-tidy fixes

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This commit is contained in:
Axel Kohlmeyer
2024-02-09 06:22:10 -05:00
parent 9c6e88f575
commit f8885cb266
3 changed files with 4 additions and 4 deletions
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2
src/AMOEBA/pair_amoeba.cpp
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@ -843,7 +843,7 @@ void PairAmoeba::init_style()
} else { } else {
index[i] = atom->find_custom(names[i], flag, cols); index[i] = atom->find_custom(names[i], flag, cols);
} }
std::string err = ""; std::string err;
if (index[i] < 0) err = "was not defined"; if (index[i] < 0) err = "was not defined";
else if (flag_check[i] != flag) err = "has the wrong type"; else if (flag_check[i] != flag) err = "has the wrong type";
else if (cols_check[i] != cols) err = "has the wrong number of columns"; else if (cols_check[i] != cols) err = "has the wrong number of columns";

4
src/lammps.cpp
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@ -150,7 +150,7 @@ LAMMPS::LAMMPS(int narg, char **arg, MPI_Comm communicator) :
if (has_git_info() && ((update_string == " - Development") || (update_string == " - Maintenance"))) if (has_git_info() && ((update_string == " - Development") || (update_string == " - Maintenance")))
update_string += fmt::format(" - {}", git_descriptor()); update_string += fmt::format(" - {}", git_descriptor());
external_comm = 0; external_comm = MPI_COMM_NULL;
mdicomm = nullptr; mdicomm = nullptr;
skiprunflag = 0; skiprunflag = 0;
@ -807,7 +807,7 @@ LAMMPS::~LAMMPS() noexcept(false)
// free a copy of uorig here, so check in universe destructor will still work // free a copy of uorig here, so check in universe destructor will still work
MPI_Comm copy = universe->uorig; MPI_Comm copy = universe->uorig;
if (external_comm) MPI_Comm_free(&copy); if (external_comm != MPI_COMM_NULL) MPI_Comm_free(&copy);
delete input; delete input;
delete universe; delete universe;

2
unittest/formats/test_molecule_file.cpp
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@ -147,7 +147,7 @@ protected:
fclose(fp); fclose(fp);
command(fmt::format("molecule {} {} {}", name, file, args)); command(fmt::format("molecule {} {} {}", name, file, args));
platform::unlink(file.c_str()); platform::unlink(file);
} }
}; };