qmcplusplus::testing Namespace Reference

SpaceGrid refactored for use with batched estimator design NE should be dropped when QMCHamiltonian/SpaceGrid has been deleted. More...

Namespaces
	magdensity

Classes
class	CrowdWithWalkers
struct	CUDAHandles
	Doesn't depend on the resource management scheme thats out of scope for unit tests. More...
class	DMCBatchedTest
class	EnergyDensityTests
class	EstimatorManagerBaseTest
	Testing class breaking EstimatorManagerBase encapsultation. More...
class	EstimatorManagerCrowdTest
	Testing class breaking EstimatorManagerCrowd encapsultation. More...
class	EstimatorManagerInputTests
class	EstimatorManagerNewTest
	Testing class breaking EstimatorManagerNew encapsultation. More...
class	EstimatorManagerNewTestAccess
struct	InvalidOneBodyDensityMatricesInput
struct	InvalidReferencePointsInputs
struct	InvalidSpaceGridInput
class	LinearMethodTestSupport
class	MagnetizationDensityTests
class	MakeRngSpdMatrix
	Functor to provide scope for rng when making SpdMatrix for testing. More...
class	MakeRngVector
	Functor to provide scope for rng when making SpdMatrix for testing. More...
class	MatrixAccessor
	Read only access, for testing! More...
class	MockPerParticleEstimator
class	MockQMCHamiltonianAndReporter
	Mock class that collects ListnerVectors as QMCHamiltonian does and reports ListenerVectors Hamiltonian operators do when they report per particle values. More...
class	MomentumDistributionTests
	class to preserve access control in MomentumDistribution More...
class	NESpaceGridTests
class	OEBAccessor
	break encapsulation of data_ by OperatorEstBase only for testing! More...
class	OneBodyDensityMatricesTests
class	QMCDriverNewTestWrapper
class	QMCDriverPools
class	RandomForTest
	Get a known sequence of random numbers for testing. More...
class	SetupDMCTest
class	SetupPools
class	SetupSFNBranch
class	SetupSimpleFixedNodeBranch
class	SpaceGridEnv
class	SpaceGridEnv< ValidSpaceGridInput::valid::CYLINDRICAL >
class	SpinDensityNewTests
	class to preserve access control in MomentumDistribution More...
class	TestableNEReferencePoints
class	TestNonLocalECPotential
	class to violate access control because evaluation of NonLocalECPotential uses RNG which we may not be able to control. More...
class	TestSOECPotential
class	UnifiedDriverWalkerControlMPITest
	Once there is only one driver type rename. More...
struct	ValidOneBodyDensityMatricesInput
struct	ValidReferencePointsInputs
struct	ValidScalarEstimatorInput
struct	ValidSpaceGridInput
struct	ValidSpinDensityInput
class	VMCBatchedTest
class	WalkerConsumer
	mock class to avoid testing dependency between Crowd and MCPopulation More...

Typedefs
using	scalar_input = testing::ValidScalarEstimatorInput
using	POLT = PtclOnLatticeTraits
using	Lattice = POLT::ParticleLayout
using	OBDMI = OneBodyDensityMatricesInput

Enumerations
enum	MA_ori { ROW, COLUMN }
enum	SpeciesCases { GOOD, NO_MEMBERSIZE }

Functions
template<typename T , typename = typename std::enable_if<std::is_floating_point<T>::value, void>::type>
void	makeRngSpdMatrix (testing::RandomForTest< RngValueType< T >> &rng, Matrix< T > &mat_spd)
template<typename T , typename = typename std::enable_if<std::is_floating_point<T>::value, void>::type>
void	makeRngVector (testing::RandomForTest< RngValueType< T >> &rng, Vector< T > &vec)
	make a random Vector More...
std::vector< QMCTraits::ValueType > &	getMyVarsFull (RotatedSPOs &rot)
std::vector< std::vector< QMCTraits::ValueType > > &	getHistoryParams (RotatedSPOs &rot)
opt_variables_type &	getMyVars (SPOSet &spo)
	TEST_CASE ("ListenerVector", "[hamiltonian]")
template<typename T >
auto	getParticularListener (Matrix< T > &local_pots)
template<typename T >
auto	getSummingListener (Matrix< T > &local_pots)
Libxml2Document	createEstimatorManagerNewGlobalInputXML ()
Libxml2Document	createEstimatorManagerNewInputXML ()
Libxml2Document	createEstimatorManagerNewVMCInputXML ()
Lattice	makeTestLattice ()
SpeciesSet	makeSpeciesSet (const SpeciesCases species_case)
template<bool GEN_TEST_DATA>
std::vector< ParticleSet >	generateRandomParticleSets (ParticleSet &pset_target, ParticleSet &pset_source, std::vector< ParticleSet::ParticlePos > &deterministic_rs, int num_psets)
	This function sets particle set positions from a set of Rs or writes out a set of positions for test reproducibility. More...
template std::vector< ParticleSet >	generateRandomParticleSets< false > (ParticleSet &pset_target, ParticleSet &pset_source, std::vector< ParticleSet::ParticlePos > &deterministic_rs, int num_psets)
template std::vector< ParticleSet >	generateRandomParticleSets< true > (ParticleSet &pset_target, ParticleSet &pset_source, std::vector< ParticleSet::ParticlePos > &deterministic_rs, int num_psets)
auto	createDriver (const RuntimeOptions &runtime_options, Communicate *comm, QMCDriverFactory &driver_factory, xmlNodePtr node, QMCDriverFactory::DriverAssemblyState &das)

Variables
constexpr std::array< std::string_view, 3 >	invalid_mag_density_input_sections
constexpr int	invalid_magnetization_density_integrator = 0
constexpr int	invalid_magnetization_density_cornercenter = 1
constexpr int	invalid_magnetization_density_badgrid = 2
constexpr std::array< std::string_view, 2 >	valid_momentum_distribution_input_sections
constexpr std::array< const char *, 4 >	valid_vmc_input_sections
constexpr int	valid_vmc_input_vmc_index = 0
constexpr int	valid_vmc_input_vmc_batch_index = 1
constexpr int	valid_vmc_input_vmc_tiny_index = 2
constexpr int	valid_vmc_batch_input_vmc_batch_index = 3
constexpr std::array< const char *, 3 >	valid_dmc_input_sections
constexpr int	valid_dmc_input_dmc_index = 0
constexpr int	valid_dmc_input_dmc_batch_index = 1
constexpr int	valid_dmc_batch_input_dmc_batch_index = 2
constexpr std::array< const char *, 2 >	valid_opt_input_sections
	As far as I can tell these are no longer valid. More...

Detailed Description

SpaceGrid refactored for use with batched estimator design NE should be dropped when QMCHamiltonian/SpaceGrid has been deleted.

Unit testing an impure virtual base class requires a absolute minimal subtype.

This class has more going on than just representing a spacial grid I'm still working out how much of this just because of the Voronoi code that shouldn't be part of the same class as the simpler grid and how much is particleset contimination etc.

For memory considerations it is quite possible this could be at single precision even if the actual montecarlo is being carried out in double precision. Eventually this should be determined from input in some way.

---

Class Documentation

qmcplusplus::testing::EnergyDensityTests

class qmcplusplus::testing::EnergyDensityTests

template<typename T>
class qmcplusplus::testing::EnergyDensityTests< T >

Definition at line 29 of file ReferencePointsInput.h.

Collaboration diagram for EnergyDensityTests< T >:

Typedef Documentation

Lattice

using Lattice = POLT::ParticleLayout

Definition at line 26 of file EstimatorTesting.h.

OBDMI

using OBDMI = OneBodyDensityMatricesInput

Definition at line 55 of file test_OneBodyDensityMatrices.cpp.

POLT

using POLT = PtclOnLatticeTraits

Definition at line 25 of file EstimatorTesting.h.

scalar_input

using scalar_input = testing::ValidScalarEstimatorInput

Definition at line 24 of file EstimatorManagerInputTest.cpp.

Enumeration Type Documentation

MA_ori

enum MA_ori

strong

Enumerator
ROW
COLUMN

Definition at line 18 of file MatrixAccessor.hpp.

{
  ROW,
  COLUMN
};

SpeciesCases

enum SpeciesCases

strong

Enumerator
GOOD
NO_MEMBERSIZE

Definition at line 28 of file EstimatorTesting.h.

{
  GOOD,
  NO_MEMBERSIZE
};

Function Documentation

createDriver()

auto qmcplusplus::testing::createDriver	(	const RuntimeOptions &	runtime_options,
		Communicate *	comm,
		QMCDriverFactory &	driver_factory,
		xmlNodePtr	node,
		QMCDriverFactory::DriverAssemblyState &	das
	)

Definition at line 53 of file test_QMCDriverFactory.cpp.

References qmcplusplus::comm, QMCDriverFactory::createQMCDriver(), ParticleSetPool::getWalkerSet(), QMCDriverPools::hamiltonian, qmcplusplus::node, QMCDriverPools::particle, and QMCDriverPools::wavefunction.

Referenced by qmcplusplus::TEST_CASE().

{
  QMCDriverPools dr_pools(runtime_options, comm);
  std::string target("e");
  MCWalkerConfiguration* qmc_system = dr_pools.particle.getWalkerSet(target);
  return driver_factory.createQMCDriver(node, das, std::nullopt, *qmc_system, dr_pools.particle, dr_pools.wavefunction,
                                        dr_pools.hamiltonian, comm);
}

createEstimatorManagerNewGlobalInputXML()

Libxml2Document createEstimatorManagerNewGlobalInputXML

(

)

Definition at line 26 of file EstimatorManagerInputTest.cpp.

References Libxml2Document::addChild(), qmcplusplus::doc, qmcplusplus::estimators_doc, Libxml2Document::getRoot(), ValidScalarEstimatorInput::LOCAL_ENERGY, Libxml2Document::newDoc(), qmcplusplus::node, qmcplusplus::okay, Libxml2Document::parseFromString(), qmcplusplus::REQUIRE(), and ValidScalarEstimatorInput::xml.

Referenced by qmcplusplus::TEST_CASE().

{
  const int max_node_recurse = 3;
  Libxml2Document estimators_doc;
  estimators_doc.newDoc("Estimators");
  {
    Libxml2Document doc;
    bool okay = doc.parseFromString(scalar_input::xml[scalar_input::LOCAL_ENERGY]);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }

  return estimators_doc;
}

createEstimatorManagerNewInputXML()

Libxml2Document createEstimatorManagerNewInputXML

(

)

Definition at line 42 of file EstimatorManagerInputTest.cpp.

References Libxml2Document::addChild(), qmcplusplus::doc, qmcplusplus::estimators_doc, Libxml2Document::getRoot(), Libxml2Document::newDoc(), qmcplusplus::node, qmcplusplus::okay, Libxml2Document::parseFromString(), qmcplusplus::REQUIRE(), valid_momentum_distribution_input_sections, and ValidScalarEstimatorInput::xml.

Referenced by qmcplusplus::TEST_CASE().

{
  const int max_node_recurse = 3;
  Libxml2Document estimators_doc;
  estimators_doc.newDoc("Estimators");
  {
    using Input = testing::ValidOneBodyDensityMatricesInput;
    Libxml2Document doc;
    bool okay = doc.parseFromString(Input::xml[0]);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }
  {
    Libxml2Document doc;
    bool okay = doc.parseFromString(valid_momentum_distribution_input_sections[0]);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }
  for (auto& input_xml : scalar_input::xml)
  {
    Libxml2Document doc;
    bool okay = doc.parseFromString(input_xml);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }

  return estimators_doc;
}

createEstimatorManagerNewVMCInputXML()

Libxml2Document createEstimatorManagerNewVMCInputXML

(

)

Definition at line 74 of file EstimatorManagerInputTest.cpp.

References Libxml2Document::addChild(), qmcplusplus::doc, qmcplusplus::estimators_doc, Libxml2Document::getRoot(), ValidScalarEstimatorInput::LOCAL_ENERGY, Libxml2Document::newDoc(), qmcplusplus::node, qmcplusplus::okay, Libxml2Document::parseFromString(), qmcplusplus::REQUIRE(), valid_momentum_distribution_input_sections, and ValidScalarEstimatorInput::xml.

Referenced by qmcplusplus::TEST_CASE().

{
  const int max_node_recurse = 3;
  Libxml2Document estimators_doc;
  estimators_doc.newDoc("Estimators");
  {
    using Input = testing::ValidOneBodyDensityMatricesInput;
    Libxml2Document doc;
    bool okay = doc.parseFromString(Input::xml[0]);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }
  {
    Libxml2Document doc;
    bool okay = doc.parseFromString(valid_momentum_distribution_input_sections[0]);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }
  {
    Libxml2Document doc;
    bool okay = doc.parseFromString(scalar_input::xml[scalar_input::LOCAL_ENERGY]);
    REQUIRE(okay);
    xmlNodePtr node = doc.getRoot();
    estimators_doc.addChild(xmlCopyNode(node, max_node_recurse));
  }

  return estimators_doc;
}

generateRandomParticleSets()

std::vector< ParticleSet > generateRandomParticleSets	(	ParticleSet &	pset_target,
		ParticleSet &	pset_source,
		std::vector< ParticleSet::ParticlePos > &	deterministic_rs,
		int	num_psets
	)

This function sets particle set positions from a set of Rs or writes out a set of positions for test reproducibility.

Definition at line 26 of file GenerateRandomParticleSets.cpp.

References qmcplusplus::pset_target.

{
  int nwalkers = num_psets;
  std::vector<ParticleSet> psets(num_psets, pset_target);
  if constexpr (GEN_TEST_DATA)
  {
    std::cout << "Initialize OneBodyDensityMatrices::accumulate psets with:\n{";
    std::vector<ParticleSet> psets;
    for (int iw = 0; iw < nwalkers; ++iw)
    {
      //psets.emplace_back(pset_target);
      psets.back().randomizeFromSource(pset_source);
      std::cout << "{";
      for (auto r : psets.back().R)
        std::cout << NativePrint(r) << ",";
      std::cout << "},\n";
    }
    std::cout << "}\n";
  }
  else
  {
    for (int iw = 0; iw < nwalkers; ++iw)
      psets[iw].R = deterministic_rs[iw];
  }
  return psets;
}

generateRandomParticleSets< false >()

template std::vector< ParticleSet > generateRandomParticleSets< false >	(	ParticleSet &	pset_target,
		ParticleSet &	pset_source,
		std::vector< ParticleSet::ParticlePos > &	deterministic_rs,
		int	num_psets
	)

generateRandomParticleSets< true >()

template std::vector< ParticleSet > generateRandomParticleSets< true >	(	ParticleSet &	pset_target,
		ParticleSet &	pset_source,
		std::vector< ParticleSet::ParticlePos > &	deterministic_rs,
		int	num_psets
	)

getHistoryParams()

std::vector< std::vector< QMCTraits::ValueType > > & getHistoryParams

(

RotatedSPOs &

rot

)

Definition at line 734 of file test_RotatedSPOs.cpp.

References RotatedSPOs::history_params_.

Referenced by qmcplusplus::TEST_CASE().

{ return rot.history_params_; }

getMyVars()

opt_variables_type & getMyVars

(

SPOSet &

spo

)

Definition at line 732 of file test_RotatedSPOs.cpp.

References SPOSet::myVars.

Referenced by qmcplusplus::TEST_CASE().

{ return rot.myVars; }

getMyVarsFull()

std::vector< QMCTraits::ValueType > & getMyVarsFull

(

RotatedSPOs &

rot

)

Definition at line 733 of file test_RotatedSPOs.cpp.

References RotatedSPOs::myVarsFull_.

Referenced by qmcplusplus::TEST_CASE().

{ return rot.myVarsFull_; }

getParticularListener()

auto qmcplusplus::testing::getParticularListener

(

Matrix< T > &

local_pots

)

Definition at line 21 of file TestListenerFunction.h.

References Matrix< T, Alloc >::cols(), qmcplusplus::syclBLAS::copy_n(), and Matrix< T, Alloc >::rows().

Referenced by qmcplusplus::doSOECPotentialTest(), qmcplusplus::TEST_CASE(), and qmcplusplus::testElecCase().

{
  return [&local_pots](const int walker_index, const std::string& name, const Vector<T>& inputV) {
    assert(local_pots.cols() >= inputV.size());
    assert(walker_index < local_pots.rows());
    std::copy_n(inputV.begin(), inputV.size(), local_pots[walker_index]);
  };
}

getSummingListener()

auto qmcplusplus::testing::getSummingListener

(

Matrix< T > &

local_pots

)

Definition at line 31 of file TestListenerFunction.h.

References Matrix< T, Alloc >::cols(), and Matrix< T, Alloc >::rows().

Referenced by qmcplusplus::TEST_CASE().

{
  return [&local_pots](const int walker_index, const std::string& name, const Vector<T>& inputV) {
    assert(local_pots.cols() >= inputV.size());
    assert(walker_index < local_pots.rows());
    std::transform(inputV.begin(), inputV.end(), local_pots[walker_index], local_pots[walker_index], std::plus<>{} );
  };
}

makeRngSpdMatrix()

void makeRngSpdMatrix	(	testing::RandomForTest< RngValueType< T >> &	rng,
		Matrix< T > &	mat_spd
	)

Definition at line 37 of file makeRngSpdMatrix.hpp.

References Matrix< T, Alloc >::cols(), Matrix< T, Alloc >::data(), BLAS::gemm(), LAPACK::gesvd(), qmcplusplus::n, Matrix< T, Alloc >::resize(), Matrix< T, Alloc >::rows(), Matrix< T, Alloc >::size(), and qmcplusplus::simd::transpose().

Referenced by MakeRngSpdMatrix< T >::operator()(), MakeRngVector< T >::operator()(), qmcplusplus::TEST_CASE(), qmcplusplus::test_inverse(), and qmcplusplus::testDualAllocator().

{
  int n = mat_spd.rows();
  Matrix<T> mat_a;
  mat_a.resize(n, n);
  rng.fillBufferRng(mat_a.data(), mat_a.size());
  Matrix<T> mat_a_t(mat_a);
  Matrix<T> mat_c;
  mat_c.resize(n, n);
  Matrix<T> mat_u;
  mat_u.resize(n, n);
  Matrix<T> mat_v;
  mat_v.resize(n, n);
  Matrix<T> mat_diag;
  mat_diag.resize(n, n);
  mat_diag = 0.0;
  std::vector<T> singular_values(n);
  std::vector<T> work_vec(5 * n);
  int info;
  const char trans   = 't';
  const char notrans = 'n';
  const char all     = 'a';
  BLAS::gemm(trans, notrans, n, n, n, 1.0, mat_a.data(), n, mat_a_t.data(), n, 0.0, mat_c.data(), n);
  LAPACK::gesvd(all, all, n, n, mat_c.data(), n, singular_values.data(), mat_u.data(), n, mat_v.data(), n,
                work_vec.data(), work_vec.size(), info);
  if (info == 0)
  {
    for (int i = 0; i < n; ++i)
      mat_diag(i, i) = rng();
    mat_diag += 1.0;
    // reuse mat_a_t for this intermediate resutls
    BLAS::gemm(notrans, notrans, n, n, n, 1.0, mat_u.data(), n, mat_diag.data(), n, 0.0, mat_a_t.data(), n);
    // then reuse mat_u
    BLAS::gemm(notrans, notrans, n, n, n, 1.0, mat_a_t.data(), n, mat_v.data(), n, 0.0, mat_u.data(), n);
  }
  simd::transpose(mat_u.data(), n, mat_u.cols(), mat_spd.data(), n, n);
}

makeRngVector()

void qmcplusplus::testing::makeRngVector	(	testing::RandomForTest< RngValueType< T >> &	rng,
		Vector< T > &	vec
	)

make a random Vector

Definition at line 130 of file makeRngSpdMatrix.hpp.

References Vector< T, Alloc >::data(), qmcplusplus::n, and Vector< T, Alloc >::size().

{
  int n = vec.size();
  rng.fillBufferRng(vec.data(), vec.size());
}

makeSpeciesSet()

SpeciesSet makeSpeciesSet

(

const SpeciesCases

species_case

)

Definition at line 29 of file EstimatorTesting.cpp.

References GOOD, qmcplusplus::iattribute, NO_MEMBERSIZE, and qmcplusplus::species_set.

Referenced by qmcplusplus::TEST_CASE().

{
  SpeciesSet species_set;
  switch (species_case)
  {
  case SpeciesCases::GOOD: {
    species_set.addSpecies("u");
    species_set.addSpecies("d");
    const int iattribute       = species_set.addAttribute("membersize");
    species_set(iattribute, 0) = 1;
    species_set(iattribute, 1) = 1;
    break;
  }
  case SpeciesCases::NO_MEMBERSIZE: {
    species_set.addSpecies("u");
    species_set.addSpecies("d");
    break;
  }
  }
  return species_set;
}

makeTestLattice()

Lattice makeTestLattice

(

)

Definition at line 18 of file EstimatorTesting.cpp.

References qmcplusplus::lattice.

Referenced by qmcplusplus::makePsets(), and qmcplusplus::TEST_CASE().

{
  Lattice lattice;
  lattice.BoxBConds = true; // periodic
  lattice.R = ParticleSet::Tensor_t(3.37316115, 3.37316115, 0.00000000, 0.00000000, 3.37316115, 3.37316115, 3.37316115,
                                    0.00000000, 3.37316115);
  lattice.reset();
  lattice.explicitly_defined = true;
  return lattice;
}

TEST_CASE()

qmcplusplus::testing::TEST_CASE	(	"ListenerVector"	,
		""	[hamiltonian]
	)

Definition at line 69 of file test_Listener.cpp.

References qmcplusplus::CHECK(), MockPerParticleEstimator::makeListener(), MockPerParticleEstimator::receiver_vector_, MockQMCHamiltonianAndReporter::registerVector(), and MockQMCHamiltonianAndReporter::reportVector().

{
  MockQMCHamiltonianAndReporter mock_ham_report;
  MockPerParticleEstimator mock_estimator;

  mock_ham_report.registerVector(mock_estimator.makeListener());

  mock_ham_report.reportVector();
  CHECK(mock_estimator.receiver_vector_[0] == 0);
  CHECK(mock_estimator.receiver_vector_[3] == 3);
}

Variable Documentation

invalid_mag_density_input_sections

constexpr std::array<std::string_view, 3> invalid_mag_density_input_sections

Initial value:

{
    R"XML(
<estimator type="MagnetizationDensity" name="magdensity">
  <parameter name="integrator"   >  tacocat       </parameter>
  <parameter name="samples"      >  64            </parameter>
  <parameter name="center"       >  0.0 0.0 0.1   </parameter>
  <parameter name="grid"         >  4 4 4         </parameter>
</estimator>
)XML",
    R"XML(
<estimator type="MagnetizationDensity" name="magdensity">
  <parameter name="center"       >  0.0 1.0 0.0 </parameter>
  <parameter name="corner"       >  0.0 0.1 0.0 </parameter>
  <parameter name="samples"      >  128         </parameter>
  <parameter name="dr"           >  0.1 0.1 0.1 </parameter>
</estimator>
)XML",
    R"XML(
<estimator type="MagnetizationDensity" name="magdensity">
  <parameter name="grid"       >  0.9 1 5   </parameter>
</estimator>
)XML"
    
}

Definition at line 23 of file InvalidMagnetizationDensityInput.h.

Referenced by qmcplusplus::TEST_CASE().

invalid_magnetization_density_badgrid

constexpr int invalid_magnetization_density_badgrid = 2

Definition at line 50 of file InvalidMagnetizationDensityInput.h.

invalid_magnetization_density_cornercenter

constexpr int invalid_magnetization_density_cornercenter = 1

Definition at line 49 of file InvalidMagnetizationDensityInput.h.

invalid_magnetization_density_integrator

constexpr int invalid_magnetization_density_integrator = 0

Definition at line 48 of file InvalidMagnetizationDensityInput.h.

valid_dmc_batch_input_dmc_batch_index

constexpr int valid_dmc_batch_input_dmc_batch_index = 2

Definition at line 137 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE().

valid_dmc_input_dmc_batch_index

constexpr int valid_dmc_input_dmc_batch_index = 1

Definition at line 136 of file ValidQMCInputSections.h.

Referenced by SetupDMCTest::operator()(), SetupSFNBranch::operator()(), and qmcplusplus::TEST_CASE().

valid_dmc_input_dmc_index

constexpr int valid_dmc_input_dmc_index = 0

Definition at line 135 of file ValidQMCInputSections.h.

Referenced by SetupSimpleFixedNodeBranch::operator()(), and qmcplusplus::TEST_CASE().

valid_dmc_input_sections

constexpr std::array<const char*, 3> valid_dmc_input_sections

Definition at line 90 of file ValidQMCInputSections.h.

Referenced by SetupDMCTest::operator()(), SetupSFNBranch::operator()(), SetupSimpleFixedNodeBranch::operator()(), and qmcplusplus::TEST_CASE().

valid_momentum_distribution_input_sections

constexpr std::array<std::string_view, 2> valid_momentum_distribution_input_sections

Initial value:

{
    R"(
<estimator type="MomentumDistribution" name="nofk" samples="5" kmax="3"/>
)",
    R"(
<estimator type="MomentumDistribution" name="nofk" samples="5" kmax0="3" kmax1="2" kmax2="1.5"/>
)"}

Definition at line 21 of file ValidMomentumDistributionInput.h.

Referenced by createEstimatorManagerNewInputXML(), and createEstimatorManagerNewVMCInputXML().

valid_opt_input_sections

constexpr std::array<const char*, 2> valid_opt_input_sections

Initial value:

{
    R"(
  <qmc method="opt" move="pbyp" gpu="yes">
  </qmc>
)",
    R"(
  <qmc method="opt" move="pbyp">
    <optimize method="test" output_param_file="yes"/>
    <parameter name="opt_num_crowds">                 4 </parameter>
    <parameter name="opt_crowd_size">                 8 </parameter>
  </qmc>
)"}

As far as I can tell these are no longer valid.

Definition at line 140 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE().

valid_vmc_batch_input_vmc_batch_index

constexpr int valid_vmc_batch_input_vmc_batch_index = 3

Definition at line 88 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE().

valid_vmc_input_sections

constexpr std::array<const char*, 4> valid_vmc_input_sections

Definition at line 27 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE(), and VMCBatchedTest::testCalcDefaultLocalWalkers().

valid_vmc_input_vmc_batch_index

constexpr int valid_vmc_input_vmc_batch_index = 1

Definition at line 86 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE(), and VMCBatchedTest::testCalcDefaultLocalWalkers().

valid_vmc_input_vmc_index

constexpr int valid_vmc_input_vmc_index = 0

Definition at line 85 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE().

valid_vmc_input_vmc_tiny_index

constexpr int valid_vmc_input_vmc_tiny_index = 2

Definition at line 87 of file ValidQMCInputSections.h.

Referenced by qmcplusplus::TEST_CASE().