MADNESS  0.10.1
examples Directory Reference
Directory dependency graph for examples:
examples

Directories

directory  compiler
 
directory  periodic
 

Files

file  3dharmonic.cc
 Solves for the ground state of the quantum 3d harmonic oscillator.
 
file  ac_corr.cc
 
file  array_worldobject.cc
 
file  binaryop.cc
 Illustrates general composition of two functions.
 
file  colloid.cc
 
file  csqrt.cc
 
file  dataloadbal.cc
 Illustrates how to use static data/load balancing of functions.
 
file  density_smoothing.cc
 solve the HF equations using numerical exponential MOs
 
file  derivatives.cc
 
file  dielectric.cc
 Example solution of Poisson's equation in a dielectric (polarizable) medium.
 
file  dielectric_external_field.cc
 Example solution of Laplace's equations for dielectric sphere in an external field.
 
file  dirac-hatom.cc
 solve the hydrogen atom using the 4-component Dirac equation
 
file  functionio.cc
 Example of I/O with functions.
 
file  examples/gaussian.cc
 A simple example of projecting and using MADNESS functions.
 
file  gygi_soltion.cc
 
file  h2.cc
 Solves the Hartree-Fock equations for the hydrogen molecule.
 
file  h2dft.cc
 
file  h2dynamic.cc
 
file  hatom.cc
 
file  hatom_1d.cc
 Solves the Schrodinger equation for the 1-d hydrogen atom.
 
file  hatom_energy.cc
 Compute the energy of the hydrogen atom ground state.
 
file  hatom_sf_dirac.cc
 
file  he.cc
 
file  heat.cc
 Example Green function for the 3D heat equation.
 
file  heat2.cc
 Example Green function for the 3D heat equation with a linear term.
 
file  hedft.cc
 
file  hefxc.cc
 
file  hehf.cc
 Solves the Hartree-Fock equations for the helium atom.
 
file  helium_exact.cc
 Solves the two-particle system exactly.
 
file  helium_mp2.cc
 Solves the Hartree-Fock and MP2 equations for the helium atom.
 
file  hello.cc
 Simplest example program for MADNESS.
 
file  madinfo.cc
 
file  molecularmask.h [code]
 
file  molecularsurface.cc
 
file  navstokes_cosines.cc
 Example Solving the Navier-Stokes equations.
 
file  newsolver.cc
 
file  newsolver_lda.cc
 
file  nonlinschro.cc
 Solves 1D nonlinear Schrödinger equation.
 
file  ploterr.cc
 
file  sdf_shape_tester.cc
 Demonstrates/tests use of 3D shape functions.
 
file  siam_example.cc
 A simple example of solving PDEs with MADNESS.
 
file  sininteg.cc
 Compute the integral sin(x) x=0..10.
 
file  smooth.h [code]
 
file  spectralprop.h [code]
 Spectral propagator in time using semigroup approach.
 
file  svpe.cc
 
file  tdse1d.cc
 Example propagation of TDSE (translating atom) using various propagators.
 
file  tdse_example.cc
 Evolves the hydrogen atom in imaginary and also real time.
 
file  test_derivative.cc
 
file  test_gmres.cc
 
file  testcomplexfunctionsolver.cc
 
file  testsolver.cc
 
file  testspectralprop.cc
 
file  testttg.cc
 
file  tiny.cc
 Solves the Hartree-Fock and MP2 equations for the helium atom.
 
file  vnucso.cc
 Solves the Hartree-Fock equation for the 2-cosh potential with spin-orbit in Nuclear Density Functional Theory without assumption of spatial symmetry.
 
file  vtk.cc