ERKALE
ERKALE - DFT from Hel
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File List
Here is a list of all documented files with brief descriptions:
[detail level 1234]
\-src
 o-atom
 |o*atomtable.h
 |o*integrals.h
 |\*solvers.h
 o-casida
 |o*casida.h
 |\*casida_grid.h
 o-completeness
 |o*completeness_profile.h
 |\*optimize_completeness.h
 o-contrib
 |o*co-opt.h
 |\*energy-opt.h
 o-emd
 |o*emd.h
 |o*emd_gto.h
 |o*emd_similarity.h
 |o*emd_sto.h
 |o*emdcube.h
 |o*gto_fourier.h
 |\*spherical_expansion.h
 o-external
 |o-adf
 ||o*ArrayList.h
 ||\*KFc.h
 |o*fchkpt_tools.h
 |\*storage.h
 o-slaterfit
 |o*form_exponents.h
 |\*solve_coefficients.h
 o-xrs
 |o*bfprod.h
 |o*fourierprod.h
 |o*lmtrans.h
 |o*momentum_series.h
 |\*xrsscf.h
 o*bader.h
 o*badergrid.h
 o*basis.h
 o*basislibrary.h
 o*boys.h
 o*broyden.h
 o*chebyshev.h
 o*checkpoint.h
 o*density_fitting.h
 o*dftfuncs.h
 o*dftgrid.h
 o*diis.h
 o*elements.h
 o*eri_digest.h
 o*erichol.h
 o*erifit.h
 o*eriscreen.h
 o*eritable.h
 o*eriworker.h
 o*find_molecules.h
 o*gaunt.h
 o*global.h
 o*guess.h
 o*hirshfeld.h
 o*hirshfeldi.h
 o*integrals.h
 o*lbfgs.h
 o*lebedev.h
 o*linalg.h
 o*lmgrid.h
 o*lobatto.h
 o*localization.h
 o*mathf.h
 o*obara-saika.h
 o*properties.h
 o*pzstability.h
 o*scf.h
 o*settings.h
 o*solidharmonics.h
 o*spherical_harmonics.h
 o*stockholder.h
 o*stringutil.h
 o*tempered.h
 o*timer.h
 o*trrh.h
 o*unitary.h
 o*version.h
 o*xyzutils.h
 \*zmatrix.h