#include <iostream>#include <signal.h>#include <cstdlib>#include <cstdio>#include <execinfo.h>
Functions | |
| void | a () |
| void | b () |
| void | c () |
| void | d () |
| void | e () |
| void | madness_signal_action (int signum, siginfo_t *info, void *context) |
| int | main () |
| void | print_backtrace (int fd) |
Function Documentation
◆ a()
◆ b()
◆ c()
◆ d()
◆ e()
| void e | ( | ) |
References f.
Referenced by madness::BandlimitedPropagator::BandlimitedPropagator(), madness::ConvolutionData1D< Q >::ConvolutionData1D(), madness::ConvolutionData1D< Q >::ConvolutionData1D(), madness::DFTCoulombOp< T, NDIM >::DFTCoulombOp(), madness::DFTCoulombPeriodicOp< T, NDIM >::DFTCoulombPeriodicOp(), madness::DFTNuclearChargeDensityOp< T, NDIM >::DFTNuclearChargeDensityOp(), DiracParameters::DiracParameters(), madness::ElectronicStructureParams::ElectronicStructureParams(), EwaldNuclearPotentialFunctor::EwaldNuclearPotentialFunctor(), madness::GenericConvolution1D< Q, opT >::GenericConvolution1D(), madness::Molecule::GeometryParameters::GeometryParameters(), MatrixOperator::MatrixOperator(), madness::Molecule::Molecule(), NuclearChargeDensityOp< T, NDIM >::NuclearChargeDensityOp(), ParserHandler< T, NDIM >::ParserHandler(), madness::XCfunctional::XCfunctional(), madness::Molecule::add_atom(), madness::Molecule::add_atom(), MolecularEntity::add_atom(), madness::adq1(), KPeriodicBSHOperator::apply(), madness::Solver< T, NDIM >::apply_hf_exchange(), apply_periodic_bsh(), madness::GTHPseudopotential< Q >::apply_potential(), madness::GTHPseudopotential< Q >::apply_potential_simple(), applyexpLt(), madness::GFit< T, NDIM >::bsh_fit(), madness::HartreeFock< T, NDIM >::calculate_coulomb_energy(), madness::HartreeFock< T, NDIM >::calculate_exchange_energy(), madness::DFT< T, NDIM >::calculate_tot_coulomb_energy(), madness::DFT< T, NDIM >::calculate_tot_pe_sp(), ParserHandler< T, NDIM >::changeExpr(), madness::SeparatedConvolution< Q, NDIM >::check_cubic(), madness::check_linear_dependence(), check_multiplication_table_c2v(), check_operator_multiplications_2d(), check_operator_multiplications_3d(), MySteepestDescent::check_positive(), compute_energy(), madness::MP2::compute_gQf(), madness::Nemo::compute_IR_intensities(), converge(), converge(), converge2s(), madness::Solver< T, NDIM >::csqrt(), d(), madness::d2smoothed_potential(), d_smoothed_potential(), d_smoothed_potential(), delta(), diag_and_transform(), EwaldNuclearPotentialFunctor::do_G_sum_v2(), madness::Solver< T, NDIM >::do_rhs(), madness::Solver< T, NDIM >::do_rhs_simple(), MiniDFT::doit(), doit(), dsmoothed_potential(), Ebark(), erfaroverr(), GygiPot::ESP(), madness::Function< T, NDIM >::eval(), ContractedGaussianShell::eval(), madness::ContractedGaussianShell::eval(), madness::CoreOrbital::eval(), madness::Function< T, NDIM >::eval_cube(), madness::CoreOrbital::eval_derivative(), madness::Function< T, NDIM >::eval_local_only(), madness::Function< T, NDIM >::evaldepthpt(), madness::Function< T, NDIM >::evalR(), find_fuzzy(), madness::Solver< T, NDIM >::fix_occupations(), fixphases(), fixphases(), madness::gauss_legendre_numeric(), madness::geev(), madness::geevp(), gen_ce(), madness::ggev(), madness::ggevp(), MolecularMaskBase::gradient(), guess(), guess(), guess(), guess(), guess(), guess(), guess(), guess(), guess(), madness::BasisFunctions::guess_virtual_gaussian_shell(), madness::BasisFunctions::guess_virtuals_from_file(), madness::BasisFunctions::guess_virtuals_internal(), h_orbital(), madness::Znemo::hcore_guess(), he_munge(), he_plus_orbital(), QuasiNewton::hessian_update_sr1(), madness::QuasiNewton::hessian_update_sr1(), madness::init_tensor_lapack(), madness::Solver< T, NDIM >::initial_guess(), madness::SCF::initial_guess(), initial_guess(), madness::XCfunctional::initialize(), iterate(), iterate(), iterate(), iterate(), iterate(), iterate(), iterate(), iterate_excite(), iterate_excite(), iterate_ground(), iterate_ground(), iterate_xy(), iterate_xy(), jacobi(), madness::jacobi(), jacobi(), KAIN(), Calculation::load_mos(), madness::Localizer::localize_boys(), madness::SystolicPMOrbitalLocalize::localize_PM_ij(), main(), main(), main(), main(), madness::ThreadBase::main(), make_bsh_operator(), madness::EigSolver< T, NDIM >::make_bsh_operators(), MiniDFT::make_bsh_operators(), make_bsh_operators(), MiniDFT::make_coulomb_potential(), make_coulomb_potential(), make_fit(), make_pw_matrix(), madness::MP2::make_Uphi0(), madness::Solver< T, NDIM >::matrix_exponential(), matrix_exponential(), madness::AtomicBasisSet::modify_dmat_psp(), munge(), myf(), madness::myusleep(), QuasiNewton::new_search_direction(), madness::QuasiNewton::new_search_direction(), madness::MolecularOptimizer::new_search_direction2(), norm(), nuclear_potential(), madness::HartreeFockExchangeOp< T, NDIM >::op_o(), madness::HartreeFockCoulombOp< T, NDIM >::op_r(), sgl_guess::operator()(), OpFExact::operator()(), madness::BasisFunctions::CartesianGaussian::operator()(), HeElectronicChargeDensityIGuess< T, NDIM >::operator()(), ParserHandler< T, NDIM >::operator()(), AtomicBasisFunctor< Q >::operator()(), H2Potential::operator()(), GaussianGuess< NDIM >::operator()(), madness::xc_lda_potential::operator()(), BoysLocalization::operator()(), madness::operator<<(), madness::operator<<(), opt(), opt(), optimize_coeffs(), madness::MolecularOptimizer::optimize_quasi_newton(), madness::Molecule::orient(), orth(), madness::Zcis::orthonormalize(), SurfaceMoleculeInteraction::perturbed_molecular_pot(), madness::FunctionImpl< T, NDIM >::phi_for_mul(), madness::XCfunctional::plot(), plot_symmetry_operators(), madness::XCfunctional::polyn(), potn(), madness::Solver< T, NDIM >::print_fock_matrix_eigs(), madness::FunctionNode< T, NDIM >::print_json(), Calculation::project_potential_basis(), projector_external_dof(), madness::MolecularOptimizer::projector_external_dof(), psi(), psi_func_be1(), psi_func_be1(), psi_func_he(), psi_func_he(), psi_func_he(), random_gaussian(), madness::Molecule::read(), madness::read_atom(), madness::F12Potentials::read_cabs_from_file(), MolecularEntity::read_file(), madness::QCCalculationParametersBase::read_input(), madness::QCCalculationParametersBase::read_input_and_commandline_options(), madness::QCCalculationParametersBase::read_internal(), madness::read_orbital(), madness::read_potential(), read_test_data(), madness::read_twoscale(), madness::Molecule::read_xyz(), relops_h(), rk_v(), rks_c_vwn5__(), rks_x_lda__(), madness::GenericConvolution1D< Q, opT >::rnlp(), madness::GaussianConvolution1D< Q >::rnlp(), madness::MacroTask< taskT >::MacroTaskInternal::run(), run_all_calculations(), madness::detail::adqtest::runtest(), madness::ProjRLMFunctor::screened(), madness::FunctionDefaults< NDIM >::set_defaults(), madness::CalculationParameters::set_derived_values(), Calculation::set_protocol(), madness::GFit< T, NDIM >::slater_fit(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothed_potential(), smoothing_parameter(), smoothing_parameter(), smoothing_parameter(), smoothing_parameter(), smoothing_parameter(), madness::smoothing_parameter(), SVPESolver::solve(), madness::EigSolver< T, NDIM >::solve(), madness::GaussSlater::Spp_div_S(), madness::GradientalGaussSlater::Spp_div_S(), madness::GradientalGaussSlater::Sr_div_S(), madness::GradientalGaussSlater::Srr_div_S(), madness::GradientalGaussSlater::Srrr_div_S(), madness::syev(), madness::syev(), madness::sygv(), madness::sygvp(), test(), madness::BandlimitedPropagator::test(), test(), test(), test0GaussLobatto(), Test1(), test1(), Test5(), Test6(), Test7(), test_adaptive_tree(), test_apply_push_1d(), test_basic(), test_bsh(), TEST_CASE(), test_chin_chen(), test_compress(), test_coulomb(), test_G_R_vectors(), test_gaussian_num_coeffs(), madness::test_gelss(), test_gence(), test_gence2(), test_he(), test_he_potential(), test_hf_be(), test_hf_h2(), test_hf_he(), test_hydro(), test_in(), test_io(), test_lda(), test_local(), test_math(), test_modified(), test_nuclear_energy(), test_nuclear_potential(), test_nuclear_potential2(), test_nuclear_potential3(), test_nuclear_potential_big_unit_cell(), test_opdir(), test_orthogonalization(), test_out(), test_per(), test_periodic(), test_periodic1(), test_periodic2(), test_periodic_bsh(), madness::Solver< T, NDIM >::test_periodicity(), test_plot(), test_proj(), test_qm(), test_read_restartaodata(), test_read_restartdata(), test_recursive_application(), madness::test_rnlp(), madness::test_syev(), madness::test_sygv(), madness::test_tensor_lapack(), test_trotter(), madness::test_two_scale_coefficients(), test_unaryop(), test_xc2(), test_XCOperator(), testbsh(), testgradG(), testNavierStokes(), testPeriodicCoulomb3d(), madness::time_transform(), madness::scf_data::to_json(), madness::GFit< T, NDIM >::truncate_periodic_expansion(), u(), u(), update(), MiniDFT::update(), update(), madness::PNO::update_pno(), madness::SubspaceK< T, NDIM >::update_subspace(), madness::Subspace< T, NDIM >::update_subspace(), madness::SCF::update_subspace(), Subspace::update_subspace(), Subspace::update_subspace(), V(), V(), V(), V(), V(), V(), V(), V(), V(), V(), V(), V_func_be(), V_func_be(), V_func_h2(), V_func_he(), V_func_he(), V_func_he(), GaussianGuess< NDIM >::val(), CoreFittingTarget::value(), Fred::value_and_gradient(), and madness::wall_time().
◆ madness_signal_action()
| void madness_signal_action | ( | int | signum, |
| siginfo_t * | info, | ||
| void * | context | ||
| ) |
References print_backtrace().
Referenced by main().
◆ main()
| int main | ( | void | ) |
References a(), and madness_signal_action().
◆ print_backtrace()
| void print_backtrace | ( | int | fd | ) |
Referenced by madness_signal_action().
