See Index of commands for an alphabetical list of all available commands.
Functional add-U elec-ex-corr elec-ex-corr-compare van-der-waals
Optimization converge-empty-states davidson-band-ratio elec-eigen-algo electronic-minimize electronic-scf fix-electron-density fix-electron-potential fix-occupied inverseKohnSham-minimize reorthogonalize-orbitals subspace-rotation-factor
Parameters basis box-potential elec-cutoff elec-fermi-fillings elec-initial-charge elec-n-bands electric-field fftbox kpoint kpoint-folding CommandSpinRestricted spintype target-mu Vexternal
Geometry coords-type ion latt-scale lattice
Optimization core-overlap-check ionic-minimize latt-move-scale lattice-minimize wavefunction-drag
Species chargeball ion-species setVDW tau-core
coulomb-interaction coulomb-truncation-embed coulomb-truncation-ion-margin exchange-regularization rhoExternal
Constitutents fluid-anion fluid-cation fluid-mixing-functional fluid-site-params fluid-solvent
Optimization fluid-gummel-loop fluid-minimize
Parameters fluid fluid-dielectric-constant fluid-ex-corr fluid-vdwScale ion-width pcm-nonlinear-debug pcm-params pcm-variant
elec-initial-fillings elec-initial-Haux fluid-initial-state initial-magnetic-moments initial-oxidation-state initial-state lcao-params wavefunction
charged-defect charged-defect-correction debug density-of-states dump dump-Eresolved-density dump-fermi-density dump-interval dump-name dump-only electron-scattering forces-output-coords polarizability polarizability-kdiff slab-epsilon vibrations
cache-projectors custom-filling eigen-shift invertKohnSham symmetries symmetry-matrix
wannier wannier-center wannier-center-pinned wannier-dump-name wannier-initial-state wannier-minimize