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apply clang-format settings to the c++ sources in the unittest tree

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This commit is contained in:
Axel Kohlmeyer
2020-06-13 01:54:58 -04:00
parent 4d62ea98cf
commit 3db944decc
18 changed files with 1400 additions and 1429 deletions
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80
unittest/formats/test_eim_potential_file_reader.cpp
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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "gmock/gmock.h"
#include "gtest/gtest.h"
#include "MANYBODY/pair_eim.h"
#include "lammps.h"
#include "utils.h"
#include "MANYBODY/pair_eim.h"
#include "gmock/gmock.h"
#include "gtest/gtest.h"
#include <mpi.h>
@ -23,19 +23,21 @@ using namespace LAMMPS_NS;
class EIMPotentialFileReaderTest : public ::testing::Test {
protected:
LAMMPS * lmp;
LAMMPS *lmp;
PairEIM::Setfl setfl;
static const int nelements = 9;
void SetUp() override {
const char *args[] = {"PotentialFileReaderTest", "-log", "none", "-echo", "screen", "-nocite" };
void SetUp() override
{
const char *args[] = {
"PotentialFileReaderTest", "-log", "none", "-echo", "screen", "-nocite"};
char **argv = (char **)args;
int argc = sizeof(args)/sizeof(char *);
int argc = sizeof(args) / sizeof(char *);
::testing::internal::CaptureStdout();
lmp = new LAMMPS(argc, argv, MPI_COMM_WORLD);
::testing::internal::GetCapturedStdout();
int npair = nelements*(nelements+1)/2;
int npair = nelements * (nelements + 1) / 2;
setfl.ielement = new int[nelements];
setfl.mass = new double[nelements];
setfl.negativity = new double[nelements];
@ -59,28 +61,29 @@ protected:
setfl.tp = new int[npair];
}
void TearDown() override {
delete [] setfl.ielement;
delete [] setfl.mass;
delete [] setfl.negativity;
delete [] setfl.ra;
delete [] setfl.ri;
delete [] setfl.Ec;
delete [] setfl.q0;
delete [] setfl.rcutphiA;
delete [] setfl.rcutphiR;
delete [] setfl.Eb;
delete [] setfl.r0;
delete [] setfl.alpha;
delete [] setfl.beta;
delete [] setfl.rcutq;
delete [] setfl.Asigma;
delete [] setfl.rq;
delete [] setfl.rcutsigma;
delete [] setfl.Ac;
delete [] setfl.zeta;
delete [] setfl.rs;
delete [] setfl.tp;
void TearDown() override
{
delete[] setfl.ielement;
delete[] setfl.mass;
delete[] setfl.negativity;
delete[] setfl.ra;
delete[] setfl.ri;
delete[] setfl.Ec;
delete[] setfl.q0;
delete[] setfl.rcutphiA;
delete[] setfl.rcutphiR;
delete[] setfl.Eb;
delete[] setfl.r0;
delete[] setfl.alpha;
delete[] setfl.beta;
delete[] setfl.rcutq;
delete[] setfl.Asigma;
delete[] setfl.rq;
delete[] setfl.rcutsigma;
delete[] setfl.Ac;
delete[] setfl.zeta;
delete[] setfl.rs;
delete[] setfl.tp;
::testing::internal::CaptureStdout();
delete lmp;
@ -88,7 +91,8 @@ protected:
}
};
TEST_F(EIMPotentialFileReaderTest, global_line) {
TEST_F(EIMPotentialFileReaderTest, global_line)
{
::testing::internal::CaptureStdout();
EIMPotentialFileReader reader(lmp, "ffield.eim");
::testing::internal::GetCapturedStdout();
@ -99,7 +103,8 @@ TEST_F(EIMPotentialFileReaderTest, global_line) {
ASSERT_DOUBLE_EQ(setfl.rsmall, 1.645);
}
TEST_F(EIMPotentialFileReaderTest, element_line_sequential) {
TEST_F(EIMPotentialFileReaderTest, element_line_sequential)
{
::testing::internal::CaptureStdout();
EIMPotentialFileReader reader(lmp, "ffield.eim");
::testing::internal::GetCapturedStdout();
@ -123,7 +128,8 @@ TEST_F(EIMPotentialFileReaderTest, element_line_sequential) {
ASSERT_DOUBLE_EQ(setfl.q0[1], 0.0000e+00);
}
TEST_F(EIMPotentialFileReaderTest, element_line_random) {
TEST_F(EIMPotentialFileReaderTest, element_line_random)
{
::testing::internal::CaptureStdout();
EIMPotentialFileReader reader(lmp, "ffield.eim");
::testing::internal::GetCapturedStdout();
@ -138,7 +144,8 @@ TEST_F(EIMPotentialFileReaderTest, element_line_random) {
ASSERT_DOUBLE_EQ(setfl.q0[0], 0.0000e+00);
}
TEST_F(EIMPotentialFileReaderTest, pair_line) {
TEST_F(EIMPotentialFileReaderTest, pair_line)
{
::testing::internal::CaptureStdout();
EIMPotentialFileReader reader(lmp, "ffield.eim");
::testing::internal::GetCapturedStdout();
@ -147,7 +154,7 @@ TEST_F(EIMPotentialFileReaderTest, pair_line) {
ASSERT_DOUBLE_EQ(setfl.rcutphiA[0], 6.0490e+00);
ASSERT_DOUBLE_EQ(setfl.rcutphiR[0], 6.0490e+00);
ASSERT_DOUBLE_EQ(setfl.Eb[0], -2.5330e-01);
ASSERT_DOUBLE_EQ(setfl.r0[0], 3.6176e+00);
ASSERT_DOUBLE_EQ(setfl.r0[0], 3.6176e+00);
ASSERT_DOUBLE_EQ(setfl.alpha[0], 7.5536e+00);
ASSERT_DOUBLE_EQ(setfl.beta[0], 3.5017e+00);
ASSERT_DOUBLE_EQ(setfl.rcutq[0], 0.0000e+00);
@ -160,7 +167,8 @@ TEST_F(EIMPotentialFileReaderTest, pair_line) {
ASSERT_EQ(setfl.tp[0], 1);
}
TEST_F(EIMPotentialFileReaderTest, pair_identical) {
TEST_F(EIMPotentialFileReaderTest, pair_identical)
{
::testing::internal::CaptureStdout();
EIMPotentialFileReader reader(lmp, "ffield.eim");
::testing::internal::GetCapturedStdout();