Solves 1D nonlinear Schrödinger equation. More...
Functions | |
| static double | guess (const coord_1d &r) |
| void | iterate (World &world, real_function_1d &psi) |
| int | main (int argc, char **argv) |
| real_function_1d | make_potential (World &world, const real_function_1d &rho) |
| double | munge (double x, double xmin, double xmax) |
| template<typename T > | |
| static void | Vdynamic (const Key< 1 > &key, Tensor< T > &t) |
| static double | Vstatic (const coord_1d &r) |
Variables | |
| static const double | a = 0.125 |
| static const double | b = 1.0 |
| static const double | c = 1.0 |
| static const double | d = 1.0 |
| static double | eta = eta_end*1024 |
| static const double | eta_end = 1e-5 |
| static const long | k = 10 |
| static const double | L = 10.0 |
| static const double | ntol = thresh*10.0 |
| static const double | thresh = 1e-8 |
| static const double | vasymp = c/std::pow(eta_end,1.0/3.0) |
| static const double | vshift = -3.0 |
Detailed Description
Solves 1D nonlinear Schrödinger equation.
Function Documentation
◆ guess()
◆ iterate()
| void iterate | ( | World & | world, |
| real_function_1d & | psi | ||
| ) |
References e(), energy, madness::inner(), make_potential(), op(), madness::print(), psi(), madness::Tensor< T >::scale(), and v.
Referenced by main().
◆ main()
| int main | ( | int | argc, |
| char ** | argv | ||
| ) |
References SafeMPI::COMM_WORLD, eta, eta_end, madness::WorldGopInterface::fence(), madness::finalize(), madness::World::gop, guess(), madness::initialize(), iterate(), k, L, lo, make_potential(), madness::plot_line(), madness::print(), psi(), madness::scale(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::FunctionDefaults< NDIM >::set_k(), madness::FunctionDefaults< NDIM >::set_thresh(), madness::FunctionDefaults< NDIM >::set_truncate_mode(), madness::startup(), thresh, v, and vasymp.
◆ make_potential()
| real_function_1d make_potential | ( | World & | world, |
| const real_function_1d & | rho | ||
| ) |
References madness::copy(), and Vstatic().
◆ munge()
| double munge | ( | double | x, |
| double | xmin, | ||
| double | xmax | ||
| ) |
Referenced by Vdynamic().
◆ Vdynamic()
◆ Vstatic()
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static |
Referenced by make_potential().
Variable Documentation
◆ a
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static |
Referenced by madness::commandlineparser::commandlineparser(), Fred::Fred(), madness::GradientalGaussSlater::GradientalGaussSlater(), madness::LinearSlater::LinearSlater(), madness::poly4erfc::poly4erfc(), madness::Polynomial< N >::Polynomial(), madness::Slater::Slater(), madness::poly4erfc::a_param(), std::abs(), madness::add(), madness::add(), madness::add(), madness::add(), madness::add(), madness::add(), madness::aligned_add(), madness::aligned_axpy(), madness::aligned_axpy(), madness::aligned_axpy(), madness::aligned_axpy(), madness::aligned_sub(), madness::aligned_zero(), madness::CCPairFunction< T, NDIM >::apply(), madness::apply(), madness::SCFProtocol::approx(), arithmetic_series(), madness::Polynomial< N >::b_param(), madness::Group::Impl::begin(), beta_func(), madness::bgq_mtxmq_padded(), madness::bgq_mtxmq_padded(), madness::bgq_mtxmq_padded(), madness::bgq_mtxmq_padded(), C(), Calculation::calc_deriv(), cfrac(), madness::Displacements< NDIM >::cmp_keys(), madness::Displacements< NDIM >::cmp_keys_periodicsum(), madness::LoadBalanceDeux< NDIM >::compare(), madness::PNO::compute_cispd_correction_es(), madness::PNO::compute_cispd_correction_gs(), madness::PNO::compute_cispd_fluctuation_matrix(), compute_energy(), madness::max_of_x_1_smooth::compute_factor(), madness::MP2::compute_gQf(), madness::CC2::compute_local_coupling(), madness::Zcis::compute_potentials(), madness::PNO::compute_projected_mp2_energies(), madness::F12Potentials::compute_regularized_fluctuation_matrix(), madness::max_of_x_1_smooth::compute_tightness(), madness::F12Potentials::compute_xyab_integrals(), madness::SVDTensor< T >::concatenate(), madness::concatenate_columns(), madness::concatenate_rows(), madness::MyPmap< D >::costmapcmp(), madness::create_nuclear_correlation_factor(), madness::cycle_count(), delsqfred(), madness::distance(), distance(), madness::distance(), madness::distance(), madness::distance(), madness::distributed_localize_PM(), do_test_random(), madness::dot(), dot_product(), drot(), madness::drot(), drot3(), madness::dsmoothed_potential(), madness::Group::Impl::end(), madness::WorldProfileEntry::exclusivebytcmp(), madness::WorldProfileEntry::exclusivecmp(), madness::fast_transpose(), fred(), gaussian(), gaussian1(), gaussian2(), gaussian3(), gaussian_energy(), madness::ScalarResult< T >::gaxpy(), madness::gaxpy(), madness::FunctionSpace< T, NDIM >::gaxpy(), madness::gaxpy(), madness::Tensor< T >::gaxpy(), madness::VectorOfFunctionsSpace< T, VDIM, FDIM >::gaxpy(), madness::VectorSpace< T, NDIM >::gaxpy(), madness::gaxpy(), madness::gaxpy(), gaxpy1(), madness::gaxpy_oop(), madness::gaxpy_oop(), geev_(), geev_(), geev_(), geev_(), madness::gelss(), gelss_(), gelss_(), gelss_(), gelss_(), madness::cblas::gemm(), madness::cblas::gemm(), madness::cblas::gemm(), madness::cblas::gemm(), geometric_series(), geqp3_(), geqp3_(), geqp3_(), geqp3_(), geqrf_(), geqrf_(), geqrf_(), geqrf_(), madness::gesv(), gesvd_(), gesvd_(), gesvd_(), gesvd_(), madness::gesvp(), get_coeffs_pw(), getrf_(), getrf_(), getrf_(), getrf_(), getri_(), getri_(), getri_(), getri_(), ggev_(), ggev_(), ggev_(), ggev_(), guess(), madness::hash_value(), hashbig(), hashlittle(), hashlittle2(), hashword(), madness::detail::htons_x(), TTT::hugh(), madness::WorldProfileEntry::inclusivebytcmp(), madness::WorldProfileEntry::inclusivecmp(), inner(), madness::inner(), madness::inner(), inner(), inner_func(), madness::CCPairFunction< T, NDIM >::inner_internal(), madness::inverse(), is_like(), jacobi(), TTT::jody(), madness::archive::ArchiveLoadImpl< ParallelInputArchive< archiveT >, CCPairFunction< T, NDIM > >::load(), madness::Localizer::localize_new(), madness::SystolicPMOrbitalLocalize::localize_PM_ij(), LSQ(), main(), main(), main(), madness::Zcis::make_CIS_matrix(), madness::TDHF::make_cis_matrix(), make_fit(), madness::TDHF::make_guess_from_initial_diagonalization(), madness::MP2::make_KffKphi0(), madness::MP2::make_Uphi0(), matrix_inner(), madness::WorldGopInterface::max(), madness::WorldGopInterface::min(), mTxm(), madness::mTxm(), mTxm(), madness::mTxm(), madness::mTxm(), mTxm_dgemm(), madness::mTxm_reference(), mTxm_tune(), mTxm_tune(), mTxm_zgemm(), madness::mTxmq(), mtxmq(), mTxmq(), mtxmq(), mtxmq(), mtxmq(), mTxmq(), mTxmq(), madness::mTxmq(), madness::mTxmq_padding(), madness::mTxmq_reference(), madness::mTxmT(), madness::mTxmT(), madness::mTxmT(), madness::mTxmT_reference(), madness::mul(), madness::mul(), madness::mul(), madness::mul(), madness::mul_sparse(), madness::mul_sparse(), madness::SeparatedConvolution< Q, NDIM >::munorm2_ns(), madness::mxm(), madness::mxm(), madness::mxm(), madness::mxm_reference(), madness::mxmT(), madness::mxmT(), madness::mxmT(), madness::mxmT_reference(), madness::my_conj_transpose(), madness::my_conj_transpose(), madness::my_conj_transpose(), madness::my_conj_transpose(), madness::Hash_private::HashIterator< hashT >::operator!=(), madness::TensorIterator< T, Q, R >::operator!=(), madness::operator!=(), GaussianPotential::operator()(), MatrixOperator::operator()(), madness::WorldSumOp< T >::operator()(), madness::WorldMultOp< T >::operator()(), madness::WorldMaxOp< T >::operator()(), madness::WorldAbsMaxOp< T >::operator()(), madness::WorldMinOp< T >::operator()(), madness::WorldAbsMinOp< T >::operator()(), madness::WorldBitAndOp< T >::operator()(), madness::WorldBitOrOp< T >::operator()(), madness::WorldBitXorOp< T >::operator()(), madness::WorldLogicAndOp< T >::operator()(), madness::WorldLogicOrOp< T >::operator()(), madness::FunctionImpl< T, NDIM >::do_check_symmetry_local::operator()(), madness::FunctionImpl< T, NDIM >::do_err_box< opT >::operator()(), madness::FunctionImpl< T, NDIM >::do_norm2sq_local::operator()(), madness::FunctionImpl< T, NDIM >::do_inner_local< R >::operator()(), madness::FunctionImpl< T, NDIM >::do_inner_local_on_demand< R >::operator()(), madness::FunctionImpl< T, NDIM >::do_inner_ext_local_ffi::operator()(), F::operator*(), madness::operator*(), madness::LowRankFunction< T, NDIM, LDIM >::operator*(), operator*(), madness::operator*(), madness::LowRankFunction< T, NDIM, LDIM >::operator*(), F::operator*(), Fcwf::operator*(), operator*(), madness::LowRankFunction< T, NDIM, LDIM >::operator*=(), madness::response_space::operator*=(), madness::response_space::operator+=(), madness::X_space::operator+=(), madness::operator<(), operator<<(), madness::operator<<(), madness::operators::operator<<(), madness::Hash_private::HashIterator< hashT >::operator==(), operator==(), madness::TensorIterator< T, Q, R >::operator==(), madness::operator==(), orgqr_(), orgqr_(), orgqr_(), orgqr_(), madness::TDHF::oscillator_strength_length(), madness::TDHF::oscillator_strength_velocity(), plot(), madness::plot_line(), madness::plot_line(), madness::XCfunctional::polyn(), potrf_(), potrf_(), potrf_(), potrf_(), pow(), madness::print_seq(), madness::print_seq(), madness::print_seq(), madness::print_seq(), DF::print_sizes(), pstrf_(), pstrf_(), pstrf_(), pstrf_(), Q(), q(), ran_fill(), ran_fill(), madness::Zcis::read_guess(), madness::Znemo::read_reference(), madness::readmat(), real(), madness::permutation::remove_duplicates(), madness::GradientalGaussSlater::S(), madness::Slater::S(), madness::poly4erfc::S(), madness::Polynomial< N >::S(), TTT::sara(), madness::Zcis::save_guess(), madness::Znemo::save_orbitals(), madness::FunctionNode< T, NDIM >::scale(), Fcwf::scale(), Fred::set(), madness::smoothed_potential(), madness::GradientalGaussSlater::Sp(), madness::Slater::Sp(), madness::Polynomial< N >::Sp(), slymer::Gaussian_Functor::special_level(), madness::GradientalGaussSlater::Spp_div_S(), madness::Slater::Spp_div_S(), madness::poly4erfc::Spp_div_S(), madness::Polynomial< N >::Spp_div_S(), madness::GradientalGaussSlater::Sr_div_S(), madness::LinearSlater::Sr_div_S(), madness::Slater::Sr_div_S(), madness::poly4erfc::Sr_div_S(), madness::Polynomial< N >::Sr_div_S(), madness::GradientalGaussSlater::Srr_div_S(), madness::LinearSlater::Srr_div_S(), madness::Slater::Srr_div_S(), madness::Polynomial< N >::Srr_div_S(), madness::GradientalGaussSlater::Srrr_div_S(), madness::LinearSlater::Srrr_div_S(), madness::Slater::Srrr_div_S(), madness::Polynomial< N >::Srrr_div_S(), madness::archive::ArchiveStoreImpl< ParallelOutputArchive< archiveT >, CCPairFunction< T, NDIM > >::store(), madness::sub(), madness::sub(), madness::WorldGopInterface::sum(), madness::svd(), madness::svd_result(), syev_(), syev_(), syev_(), syev_(), sygv_(), sygv_(), sygv_(), sygv_(), madness::sygvp(), madness::PNO::t_solve(), tbar_OMEGA(), test(), test(), test0(), test2(), Test5(), test6(), test_accessors(), TEST_CASE(), TEST_CASE(), madness::test_cholesky(), test_compress(), test_constructor(), test_conversion(), test_convolution(), test_coverage(), test_full_rank_functor(), madness::test_gelss(), madness::test_gesv(), test_in(), test_inner(), test_inner(), test_loose1(), test_math(), test_out(), test_partial_inner_3d(), test_partial_inner_6d(), test_projector(), test_qm(), test_random(), madness::test_rnlp(), madness::test_rr_cholesky(), test_scalar_multiplication(), madness::test_svd(), test_swap_particles(), madness::test_syev(), madness::test_sygv(), test_thread(), test_tight_diffuse(), test_time(), test_truncation(), testNavierStokes(), timer(), timer(), transform(), trantimer(), trantimer(), truncate(), madness::GradientalGaussSlater::U2X_spherical(), madness::Slater::U2X_spherical(), madness::Polynomial< N >::U2X_spherical(), madness::PNO::update_pno(), updatex(), and Vstatic().
◆ b
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Referenced by Fred::Fred(), madness::X_vector::X_vector(), madness::add(), madness::add(), madness::add(), madness::add(), madness::add(), madness::add(), madness::aligned_add(), madness::aligned_axpy(), madness::aligned_axpy(), madness::aligned_axpy(), madness::aligned_axpy(), madness::aligned_sub(), madness::CCPairFunction< T, NDIM >::apply(), madness::SCFProtocol::approx(), madness::bgq_mtxmq_padded(), madness::bgq_mtxmq_padded(), madness::bgq_mtxmq_padded(), madness::bgq_mtxmq_padded(), Calculation::calc_optimal_coeffs(), cfrac(), check(), madness::Displacements< NDIM >::cmp_keys(), madness::Displacements< NDIM >::cmp_keys_periodicsum(), madness::LoadBalanceDeux< NDIM >::compare(), madness::PNO::compute_cispd_correction_es(), madness::PNO::compute_cispd_correction_gs(), madness::PNO::compute_cispd_fluctuation_matrix(), madness::max_of_x_1_smooth::compute_factor(), madness::PNO::compute_projected_mp2_energies(), madness::F12Potentials::compute_regularized_fluctuation_matrix(), madness::max_of_x_1_smooth::compute_tightness(), madness::F12Potentials::compute_xyab_integrals(), madness::concatenate_columns(), madness::concatenate_rows(), madness::MyPmap< D >::costmapcmp(), cplxfunc0(), cplxfunc1(), cplxfunc2(), cplxvec0(), cplxvec1(), cplxvec2(), madness::TensorTrain< T >::decompose(), madness::distance(), distance(), madness::distance(), madness::distance(), madness::distance(), madness::do_vtk_plots(), madness::dot(), dot_product(), drot(), madness::drot(), drot3(), madness::WorldProfileEntry::exclusivebytcmp(), madness::WorldProfileEntry::exclusivecmp(), madness::fast_transpose(), fastsum_oscillating(), madness::ScalarResult< T >::gaxpy(), madness::gaxpy(), madness::FunctionSpace< T, NDIM >::gaxpy(), madness::gaxpy(), madness::Tensor< T >::gaxpy(), madness::VectorOfFunctionsSpace< T, VDIM, FDIM >::gaxpy(), madness::VectorSpace< T, NDIM >::gaxpy(), madness::gaxpy(), madness::gaxpy(), gaxpy1(), madness::gaxpy_oop(), madness::gaxpy_oop(), madness::gelss(), gelss_(), gelss_(), gelss_(), gelss_(), madness::cblas::gemm(), madness::cblas::gemm(), madness::cblas::gemm(), madness::cblas::gemm(), madness::gesv(), madness::gesvp(), get_coeffs_pw(), ggev_(), ggev_(), ggev_(), ggev_(), madness::GMRES(), ground_exchange(), hashbig(), hashlittle(), hashlittle2(), hashword(), madness::WorldProfileEntry::inclusivebytcmp(), madness::WorldProfileEntry::inclusivecmp(), inner(), madness::inner(), madness::inner(), inner(), inner_func(), madness::CCPairFunction< T, NDIM >::inner_internal(), is_like(), TTT::jody(), KAIN(), madness::KAIN(), madness::archive::ArchiveLoadImpl< Archive, std::vector< bool, Alloc > >::load(), madness::archive::ArchiveLoadImpl< ParallelInputArchive< archiveT >, CCPairFunction< T, NDIM > >::load(), madness::MutexFair::lock(), LSQ(), main(), main(), main(), madness::TDHF::make_cis_matrix(), madness::Displacements< NDIM >::make_disp_periodicsum(), madness::Zcis::make_guess(), madness::TDHF::make_guess_from_initial_diagonalization(), matrix_inner(), molresponseExchange(), mTxm(), madness::mTxm(), mTxm(), madness::mTxm(), madness::mTxm(), mTxm_dgemm(), madness::mTxm_reference(), mTxm_tune(), mTxm_tune(), mTxm_zgemm(), madness::mTxmq(), mtxmq(), mTxmq(), mtxmq(), mtxmq(), mtxmq(), mTxmq(), mTxmq(), madness::mTxmq(), madness::mTxmq_padding(), madness::mTxmq_reference(), madness::mTxmT(), madness::mTxmT(), madness::mTxmT(), madness::mTxmT_reference(), madness::mul(), madness::mul(), madness::SeparatedConvolution< Q, NDIM >::munorm2_ns(), madness::mxm(), madness::mxm(), madness::mxm(), madness::mxm_reference(), madness::mxmT(), madness::mxmT(), madness::mxmT(), madness::mxmT_reference(), madness::X_space::norm2s(), ok(), madness::operator!=(), madness::WorldSumOp< T >::operator()(), madness::WorldMultOp< T >::operator()(), madness::WorldMaxOp< T >::operator()(), madness::WorldAbsMaxOp< T >::operator()(), madness::WorldMinOp< T >::operator()(), madness::WorldAbsMinOp< T >::operator()(), madness::WorldBitAndOp< T >::operator()(), madness::WorldBitOrOp< T >::operator()(), madness::WorldBitXorOp< T >::operator()(), madness::WorldLogicAndOp< T >::operator()(), madness::WorldLogicOrOp< T >::operator()(), madness::FunctionImpl< T, NDIM >::do_check_symmetry_local::operator()(), madness::FunctionImpl< T, NDIM >::do_err_box< opT >::operator()(), madness::FunctionImpl< T, NDIM >::do_norm2sq_local::operator()(), madness::FunctionImpl< T, NDIM >::do_inner_local< R >::operator()(), madness::FunctionImpl< T, NDIM >::do_inner_local_on_demand< R >::operator()(), madness::FunctionImpl< T, NDIM >::do_inner_ext_local_ffi::operator()(), madness::LowRankFunction< T, NDIM, LDIM >::operator+(), F::operator+=(), madness::LowRankFunction< T, NDIM, LDIM >::operator+=(), madness::response_space::operator+=(), madness::X_space::operator+=(), F::operator-(), madness::LowRankFunction< T, NDIM, LDIM >::operator-(), madness::LowRankFunction< T, NDIM, LDIM >::operator-=(), madness::CC_vecfunction::operator<(), madness::operator<(), Key::operator==(), operator==(), madness::operator==(), optimize_coeffs(), pbar_OMEGA(), plot(), madness::plot_line(), madness::XCfunctional::polyn(), pow(), madness::print_seq(), madness::print_seq(), madness::print_seq(), madness::DQueue< T >::push_back_with_lock(), realfunc0(), realfunc1(), realfunc2(), realvec0(), realvec1(), realvec2(), madness::permutation::remove_duplicates(), response_exchange(), response_exchange_multiworld(), madness::LinearSlater::S(), madness::Polynomial< N >::S(), TTT::sara(), madness::archive::ArchiveSerializeImpl< Archive, B >::serialize(), madness::WorldAmInterface::SendReq::set(), madness::Nemo::solve_cphf(), madness::LinearSlater::Sp(), madness::Polynomial< N >::Sp(), madness::LinearSlater::Spp_div_S(), madness::Polynomial< N >::Spp_div_S(), madness::Polynomial< N >::Sr_div_S(), madness::Polynomial< N >::Srr_div_S(), madness::Polynomial< N >::Srrr_div_S(), madness::archive::ArchiveStoreImpl< Archive, std::vector< bool, Alloc > >::store(), madness::archive::ArchiveStoreImpl< ParallelOutputArchive< archiveT >, CCPairFunction< T, NDIM > >::store(), madness::sub(), madness::sub(), madness::sygv(), sygv_(), sygv_(), sygv_(), sygv_(), madness::PNO::t_solve(), tbar_OMEGA(), madness::Random::test(), test(), test(), test10(), Test5(), test_batch_1D(), TEST_CASE(), TEST_CASE(), TEST_CASE(), test_constructor(), test_full_rank_functor(), madness::test_gelss(), madness::test_gesv(), test_in(), test_inner(), test_loose1(), test_math(), test_out(), test_partial_inner_3d(), test_partial_inner_6d(), test_projector(), test_scalar_multiplication(), madness::test_svd(), test_swap_particles(), madness::test_sygv(), test_tight_diffuse(), testNavierStokes(), timer(), timer(), madness::to_conjugate_response_matrix(), madness::to_conjugate_X_space(), madness::to_flattened_vector(), madness::to_response_matrix(), madness::to_X_space(), madness::transposeResponseMatrix(), trantimer(), trantimer(), madness::PNO::update_pno(), updatex(), vector_to_PQ(), Vstatic(), and madness::ConditionVariable::wait().
◆ c
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Referenced by Vdynamic().
◆ d
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Referenced by madness::IndexIterator::IndexIterator(), madness::IndexIterator::IndexIterator(), OpFExact::OpFExact(), madness::SeparatedConvolution< Q, NDIM >::SeparatedConvolution(), madness::SeparatedConvolution< Q, NDIM >::SeparatedConvolution(), madness::SeparatedConvolution< Q, NDIM >::SeparatedConvolution(), madness::Tensor< T >::Tensor(), madness::Tensor< T >::Tensor(), madness::TensorTrain< T >::TensorTrain(), madness::TensorTrain< T >::TensorTrain(), madness::TwoElectronInterface< T, NDIM >::TwoElectronInterface(), madness::WorldProfileObj::~WorldProfileObj(), madness::adq1(), madness::Tensor< T >::allocate(), madness::apply(), madness::SeparatedConvolution< Q, NDIM >::apply_transformation(), madness::SeparatedConvolution< Q, NDIM >::apply_transformation2(), area_two_spheres(), madness::SeparatedConvolution< Q, NDIM >::check_cubic(), madness::Displacements< NDIM >::cmp_keys_periodicsum(), madness::FunctionImpl< T, NDIM >::compress_op(), madness::FunctionImpl< T, NDIM >::Vphi_op_NS< opT, LDIM >::compute_error_from_inaccurate_refinement(), madness::concatenate_rows(), converge(), madness::cross(), madness::cycle_count(), madness::TensorTrain< T >::decompose(), dfunc(), dipole_generator(), madness::Key< NDIM >::distsq(), madness::LLRVDomainMask::dmask(), madness::GaussianDomainMask::dmask(), madness::FunctionImpl< T, NDIM >::do_apply(), madness::FunctionImpl< T, NDIM >::do_apply_directed_screening(), madness::Derivative< T, NDIM >::do_diff2b(), madness::Derivative< T, NDIM >::do_diff2i(), madness::FunctionImpl< T, NDIM >::do_print_grid(), madness::FunctionImpl< Q, NDIM >::do_print_tree(), Node::do_sum_spawn(), doit(), madness::LLRVDomainMask::dsurface(), madness::GaussianDomainMask::dsurface(), madness::Function< T, NDIM >::eval(), madness::Function< T, NDIM >::eval_cube(), madness::SDFParaboloid::eval_cubic(), madness::Function< T, NDIM >::eval_local_only(), madness::Function< T, NDIM >::evaldepthpt(), madness::Function< T, NDIM >::evalR(), expV(), fastsum_oscillating(), madness::FunctionImpl< T, NDIM >::fcube_for_mul(), madness::FunctionImpl< T, NDIM >::fcube_for_mul(), madness::SDFParaboloid::find_root(), madness::Tensor< T >::flat(), madness::Tensor< T >::flat(), madness::BaseTensor::flat_inplace(), func(), madness::TensorTrain< T >::fusedim(), madness::randomgrid< NDIM >::gaussian_random_distribution(), madness::TensorTrain< T >::gaxpy(), madness::TensorTrain< T >::gaxpy(), madness::FunctionImpl< T, NDIM >::gaxpy_ext_recursive(), madness::general_transform(), madness::randomgrid< NDIM >::get_grid(), madness::SDFParaboloid::get_roots(), madness::get_size(), madness::get_size(), madness::SeparatedConvolution< Q, NDIM >::getmuop(), madness::SeparatedConvolution< Q, NDIM >::getmuop_modified(), madness::SeparatedConvolution< Q, NDIM >::getop(), madness::SeparatedConvolution< Q, NDIM >::getop_ns(), madness::GradBSHOperator(), GradBSHOperator_Joel(), madness::GradCoulombOperator(), madness::gradient_operator(), gradPbarA(), madness::GradSlaterOperator(), madness::LBNodeDeux< NDIM >::index(), madness::TwoElectronInterface< T, NDIM >::initialize(), madness::SeparatedConvolution< Q, NDIM >::initialize(), madness::inner(), madness::FunctionImpl< T, NDIM >::inner_adaptive_recursive(), madness::FunctionImpl< T, NDIM >::inner_ext_recursive(), is_equal(), madness::BoundaryConditions< NDIM >::is_periodic(), TTT::kate(), madness::SystolicPMOrbitalLocalize::localize_PM_ij(), main(), main(), main(), make_dimensions(), madness::Displacements< NDIM >::make_disp(), madness::Displacements< NDIM >::make_disp_periodicsum(), make_grad_operator(), madness::FunctionImpl< T, NDIM >::make_redundant_op(), madness::smooth< T, NDIM >::make_sigma(), madness::SeparatedConvolution< Q, NDIM >::make_tt_representation(), madness::LLRVDomainMask::mask(), madness::GaussianDomainMask::mask(), madness::matrix_dot(), madness::matrix_inner(), madness::SeparatedConvolution< Q, NDIM >::munorm2_modified(), madness::SeparatedConvolution< Q, NDIM >::munorm2_ns(), madness::SeparatedConvolution< Q, NDIM >::muopxv_fast(), madness::SeparatedConvolution< Q, NDIM >::muopxv_fast2(), madness::SeparatedConvolution< Q, NDIM >::norm(), madness::Vector< T, N >::normf(), madness::FunctionImpl< T, NDIM >::NS_fcube_for_mul(), DSphere::operator()(), OpFExact::operator()(), Uop::operator()(), madness::slater_kernel::operator()(), madness::dens_inv::operator()(), madness::op_leaf_op< T, NDIM, opT >::operator()(), madness::abs_square_op< Q, NDIM >::operator()(), madness::hartree_convolute_leaf_op< T, NDIM, LDIM, opT >::operator()(), madness::Tensor< T >::operator()(), madness::Tensor< T >::operator()(), madness::Tensor< T >::operator()(), madness::Tensor< T >::operator()(), madness::int_factor_functor< NDIM >::operator()(), madness::lr_pot_functor< NDIM >::operator()(), madness::BoundaryConditions< NDIM >::operator()(), madness::BoundaryConditions< NDIM >::operator()(), madness::FunctionImpl< T, NDIM >::do_truncate_NS_leafs::operator()(), Fred::operator*(), madness::IndexIterator::operator++(), madness::HighDimIndexIterator::operator++(), madness::LowDimIndexIterator::operator++(), madness::NonstandardIndexIterator::operator++(), madness::TensorIterator< T, Q, R >::operator++(), madness::operator<<(), madness::DistributedMatrixDistribution::operator==(), madness::IndexIterator::operator[](), madness::outer(), madness::FunctionImpl< Q, NDIM >::parent_to_child(), madness::WorldProfileObj::pause(), madness::plotdx(), madness::plotpovray(), madness::XCfunctional::polyn(), madness::Leaf_op< T, NDIM, opT, specialboxT >::post_screening(), madness::print_seq(), madness::FunctionImpl< T, NDIM >::print_size(), madness::FunctionImpl< Q, NDIM >::print_timer(), madness::FunctionImpl< T, NDIM >::project_refine_op(), Node::random_insert(), Node::random_insert(), madness::FunctionImpl< T, NDIM >::reconstruct_op(), madness::FunctionImpl< T, NDIM >::recur_down_for_contraction_map(), Node::recursive_print(), madness::WorldProfile::recv_stats(), madness::FunctionImpl< T, NDIM >::refine_op(), madness::FunctionImpl< T, NDIM >::refine_to_common_level(), madness::IndexIterator::reset(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::Tensor< T >::reshape(), madness::BaseTensor::reshape_inplace(), madness::BaseTensor::reshape_inplace(), madness::rot(), madness::SDFParaboloid::sdf(), madness::BaseTensor::set_dims_and_size(), madness::FunctionImpl< T, NDIM >::sum_down_spawn(), madness::LLRVDomainMask::surface(), madness::GaussianDomainMask::surface(), madness::swap_particles(), Test1(), test1(), test11(), test12(), test13(), test2(), Test5(), test7(), test_in(), test_local(), test_opdir(), test_out(), testgradG(), testNavierStokes(), madness::TensorTrain< T >::trace(), madness::transform(), madness::TensorTrain< T >::truncate(), Vdynamic(), madness::TensorTrain< T >::verify(), volume_two_spheres(), walker1(), and walker2().
◆ eta
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static |
Referenced by main(), and Vdynamic().
◆ eta_end
◆ k
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static |
Referenced by main().
◆ L
|
static |
Referenced by main().
◆ ntol
|
static |
Referenced by Vdynamic().
◆ thresh
◆ vasymp
◆ vshift
|
static |
Referenced by Vstatic().
