use clang-tidy and clang-format to update/modernize/simplify code
This commit is contained in:
@ -34,10 +34,10 @@
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#include "lammps.h"
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#include "modify.h"
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#include "pair.h"
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#include "platform.h"
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#include "universe.h"
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#include "utils.h"
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#include "variable.h"
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#include "platform.h"
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#include <cctype>
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#include <cstdio>
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@ -92,7 +92,7 @@ LAMMPS *init_lammps(int argc, char **argv, const TestConfig &cfg, const bool use
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// utility lambda to improve readability
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auto command = [&](const std::string &line) {
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lmp->input->one(line.c_str());
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lmp->input->one(line);
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};
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command("variable input_dir index " + INPUT_FOLDER);
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@ -143,7 +143,7 @@ void restart_lammps(LAMMPS *lmp, const TestConfig &cfg, bool use_rmass, bool use
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{
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// utility lambda to improve readability
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auto command = [&](const std::string &line) {
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lmp->input->one(line.c_str());
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lmp->input->one(line);
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};
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command("clear");
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@ -184,7 +184,7 @@ void generate_yaml_file(const char *outfile, const TestConfig &config)
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}
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const int natoms = lmp->atom->natoms;
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std::string block("");
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std::string block;
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YamlWriter writer(outfile);
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// write yaml header
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@ -204,8 +204,8 @@ void generate_yaml_file(const char *outfile, const TestConfig &config)
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if (fix->thermo_virial) {
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auto stress = fix->virial;
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block = fmt::format("{:23.16e} {:23.16e} {:23.16e} "
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"{:23.16e} {:23.16e} {:23.16e}",
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stress[0], stress[1], stress[2], stress[3], stress[4], stress[5]);
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"{:23.16e} {:23.16e} {:23.16e}",
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stress[0], stress[1], stress[2], stress[3], stress[4], stress[5]);
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writer.emit_block("run_stress", block);
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}
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@ -243,7 +243,6 @@ void generate_yaml_file(const char *outfile, const TestConfig &config)
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}
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writer.emit_block("run_vel", block);
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cleanup_lammps(lmp, config);
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return;
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}
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TEST(FixTimestep, plain)
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@ -293,7 +292,8 @@ TEST(FixTimestep, plain)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (normal run, verlet)", fix->virial, test_config.run_stress, epsilon);
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EXPECT_STRESS("run_stress (normal run, verlet)", fix->virial, test_config.run_stress,
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epsilon);
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}
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stats.reset();
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@ -342,7 +342,8 @@ TEST(FixTimestep, plain)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (restart, verlet)", fix->virial, test_config.run_stress, epsilon);
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EXPECT_STRESS("run_stress (restart, verlet)", fix->virial, test_config.run_stress,
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epsilon);
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}
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stats.reset();
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@ -380,7 +381,8 @@ TEST(FixTimestep, plain)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (rmass, verlet)", fix->virial, test_config.run_stress, epsilon);
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EXPECT_STRESS("run_stress (rmass, verlet)", fix->virial, test_config.run_stress,
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epsilon);
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}
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stats.reset();
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@ -432,7 +434,8 @@ TEST(FixTimestep, plain)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (normal run, respa)", fix->virial, test_config.run_stress, 1000 * epsilon);
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EXPECT_STRESS("run_stress (normal run, respa)", fix->virial, test_config.run_stress,
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1000 * epsilon);
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}
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stats.reset();
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@ -469,7 +472,8 @@ TEST(FixTimestep, plain)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (restart, respa)", fix->virial, test_config.run_stress, 1000 * epsilon);
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EXPECT_STRESS("run_stress (restart, respa)", fix->virial, test_config.run_stress,
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1000 * epsilon);
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}
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stats.reset();
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@ -507,7 +511,8 @@ TEST(FixTimestep, plain)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (rmass, respa)", fix->virial, test_config.run_stress, 1000 * epsilon);
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EXPECT_STRESS("run_stress (rmass, respa)", fix->virial, test_config.run_stress,
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1000 * epsilon);
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}
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stats.reset();
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@ -587,7 +592,8 @@ TEST(FixTimestep, omp)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (normal run, verlet)", fix->virial, test_config.run_stress, epsilon);
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EXPECT_STRESS("run_stress (normal run, verlet)", fix->virial, test_config.run_stress,
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epsilon);
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}
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stats.reset();
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@ -636,7 +642,8 @@ TEST(FixTimestep, omp)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (restart, verlet)", fix->virial, test_config.run_stress, epsilon);
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EXPECT_STRESS("run_stress (restart, verlet)", fix->virial, test_config.run_stress,
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epsilon);
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}
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stats.reset();
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@ -674,7 +681,8 @@ TEST(FixTimestep, omp)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (rmass, verlet)", fix->virial, test_config.run_stress, epsilon);
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EXPECT_STRESS("run_stress (rmass, verlet)", fix->virial, test_config.run_stress,
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epsilon);
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}
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stats.reset();
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@ -725,7 +733,8 @@ TEST(FixTimestep, omp)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (normal run, respa)", fix->virial, test_config.run_stress, 1000 * epsilon);
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EXPECT_STRESS("run_stress (normal run, respa)", fix->virial, test_config.run_stress,
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1000 * epsilon);
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}
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stats.reset();
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@ -762,7 +771,8 @@ TEST(FixTimestep, omp)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (restart, respa)", fix->virial, test_config.run_stress, 1000 * epsilon);
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EXPECT_STRESS("run_stress (restart, respa)", fix->virial, test_config.run_stress,
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1000 * epsilon);
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}
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stats.reset();
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@ -800,7 +810,8 @@ TEST(FixTimestep, omp)
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} else {
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Fix *fix = lmp->modify->fix[ifix];
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if (fix->thermo_virial) {
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EXPECT_STRESS("run_stress (rmass, respa)", fix->virial, test_config.run_stress, 1000 * epsilon);
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EXPECT_STRESS("run_stress (rmass, respa)", fix->virial, test_config.run_stress,
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1000 * epsilon);
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}
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stats.reset();
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