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lammps
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enable testing with r-RESPA for real

This commit is contained in:
Axel Kohlmeyer 2020-08-09 17:36:15 -04:00
parent c3903efb46
commit b92eda8ab8
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GPG Key ID: D9B44E93BF0C375A
1 changed files with 14 additions and 11 deletions
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25
unittest/force-styles/test_fix_timestep.cpp
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@ -295,7 +295,7 @@ TEST(FixTimestep, plain)
int argc = sizeof(args) / sizeof(char *);
::testing::internal::CaptureStdout();
LAMMPS *lmp = init_lammps(argc, argv, test_config, false);
LAMMPS *lmp = init_lammps(argc, argv, test_config);
std::string output = ::testing::internal::GetCapturedStdout();
if (verbose) std::cout << output;
@ -523,11 +523,13 @@ TEST(FixTimestep, plain)
if (!verbose) ::testing::internal::GetCapturedStdout();
::testing::internal::CaptureStdout();
lmp = init_lammps(argc, argv, test_config, false);
lmp = init_lammps(argc, argv, test_config, true);
output = ::testing::internal::GetCapturedStdout();
if (verbose) std::cout << output;
// lower required precision by one order of magnitude to accommodate respa
epsilon *= 10.0;
x = lmp->atom->x;
tag = lmp->atom->tag;
stats.reset();
@ -588,7 +590,7 @@ TEST(FixTimestep, plain)
}
if (!verbose) ::testing::internal::CaptureStdout();
restart_lammps(lmp, test_config, false, false);
restart_lammps(lmp, test_config, false, true);
if (!verbose) ::testing::internal::GetCapturedStdout();
x = lmp->atom->x;
@ -651,7 +653,7 @@ TEST(FixTimestep, plain)
}
if (!verbose) ::testing::internal::CaptureStdout();
restart_lammps(lmp, test_config, true, false);
restart_lammps(lmp, test_config, true, true);
if (!verbose) ::testing::internal::GetCapturedStdout();
x = lmp->atom->x;
@ -729,8 +731,7 @@ TEST(FixTimestep, omp)
int argc = sizeof(args) / sizeof(char *);
::testing::internal::CaptureStdout();
LAMMPS *lmp = init_lammps(argc, argv, test_config, false);
LAMMPS *lmp = init_lammps(argc, argv, test_config);
std::string output = ::testing::internal::GetCapturedStdout();
if (verbose) std::cout << output;
@ -958,11 +959,13 @@ TEST(FixTimestep, omp)
if (!verbose) ::testing::internal::GetCapturedStdout();
::testing::internal::CaptureStdout();
lmp = init_lammps(argc, argv, test_config, false);
lmp = init_lammps(argc, argv, test_config, true);
output = ::testing::internal::GetCapturedStdout();
if (verbose) std::cout << output;
// lower required precision by one order of magnitude to accommodate respa
epsilon *= 10.0;
x = lmp->atom->x;
tag = lmp->atom->tag;
stats.reset();
@ -1023,7 +1026,7 @@ TEST(FixTimestep, omp)
}
if (!verbose) ::testing::internal::CaptureStdout();
restart_lammps(lmp, test_config, false, false);
restart_lammps(lmp, test_config, false, true);
if (!verbose) ::testing::internal::GetCapturedStdout();
x = lmp->atom->x;
@ -1086,7 +1089,7 @@ TEST(FixTimestep, omp)
}
if (!verbose) ::testing::internal::CaptureStdout();
restart_lammps(lmp, test_config, true, false);
restart_lammps(lmp, test_config, true, true);
if (!verbose) ::testing::internal::GetCapturedStdout();
x = lmp->atom->x;