Directory dependency graph for examples:
Directories | |
| directory | compiler |
Files | |
| file | 3dharmonic.cc |
| Solves for the ground state of the quantum 3d harmonic oscillator. | |
| 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 | dielectric.cc |
| Example solution of Poisson's equation in a dielectric (polarizable) medium. | |
| file | dielectric_external_field.cc |
| file | functionio.cc |
| Example of I/O with 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_1d.cc |
| Solves the Schrodinger equation for the 1-d hydrogen atomThe Hartree-Fock wave function is computed for the hydrogen atom in one dimension without using symmetry. | |
| file | examples/hatom_energy.cc |
| Compute the energy of the hydrogen atom ground state. | |
| file | he.cc |
| Solves the Hartree-Fock equations for the helium atom. | |
| 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 | hehf.cc |
| 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 | examples/hello.cc |
| Simplest example program for MADNESS. | |
| file | molecularmask.h [code] |
| file | molecularsurface.cc |
| file | examples/mp2.cc |
| file | navstokes_cosines.cc |
| Example Solving the Navier-Stokes equations. | |
| file | examples/nemo.cc |
| solve the HF equations using numerical exponential MOs | |
| file | newsolver.cc |
| file | nonlinschro.cc |
| Solves 1D nonlinear Schrödinger equation. | |
| file | nonlinsol.h [code] |
| Example implementation of Krylov-subspace nonlinear equation solver. | |
| file | oep.cc |
| optimized effective potentials for DFT | |
| file | ploterr.cc |
| file | sdf_shape_tester.cc |
| Demonstrates/tests use of 3D shape functions. | |
| file | sininteg.cc |
| Compute the integral sin(x) x=0..10. | |
| file | spectralprop.h [code] |
| Spectral propagator in time using semigroup approach. | |
| file | svpe.cc |
| file | tdhf.cc |
| compute the time-dependent HF equations (currently CIS approximation) | |
| file | examples/tdse.cc |
| Evolves the hydrogen atom in imaginary and also real time. | |
| file | tdse1d.cc |
| Example propagation of TDSE (translating atom) using various propagators. | |
| file | tiny.cc |
| file | vnucso.cc |
| Solves the spin-orbit nuclear potential problem. | |
| file | vtk.cc |
