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Update pair vashishta

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This commit is contained in:
Richard Berger
2020-05-28 16:17:15 -04:00
parent cadc374e0b
commit 5a4bbcc37a
3 changed files with 79 additions and 110 deletions
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10
unittest/formats/test_potential_file_reader.cpp
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@ -13,6 +13,7 @@
#include "MANYBODY/pair_gw.h"
#include "MANYBODY/pair_gw_zbl.h"
#include "MANYBODY/pair_nb3b_harmonic.h"
#include "MANYBODY/pair_vashishta.h"
#include <mpi.h>
@ -28,6 +29,7 @@ const int LAMMPS_NS::PairTersoffZBL::NPARAMS_PER_LINE;
const int LAMMPS_NS::PairGW::NPARAMS_PER_LINE;
const int LAMMPS_NS::PairGWZBL::NPARAMS_PER_LINE;
const int LAMMPS_NS::PairNb3bHarmonic::NPARAMS_PER_LINE;
const int LAMMPS_NS::PairVashishta::NPARAMS_PER_LINE;
class PotenialFileReaderTest : public ::testing::Test {
protected:
@ -138,6 +140,14 @@ TEST_F(PotenialFileReaderTest, Nb3bHarmonic) {
auto line = reader.next_line(PairNb3bHarmonic::NPARAMS_PER_LINE);
ASSERT_EQ(utils::count_words(line), PairNb3bHarmonic::NPARAMS_PER_LINE);
}
TEST_F(PotenialFileReaderTest, Vashishta) {
::testing::internal::CaptureStdout();
PotentialFileReader reader(lmp, "SiC.vashishta", "Vashishta");
::testing::internal::GetCapturedStdout();
auto line = reader.next_line(PairVashishta::NPARAMS_PER_LINE);
ASSERT_EQ(utils::count_words(line), PairVashishta::NPARAMS_PER_LINE);
}
int main(int argc, char **argv)
{