.. ONETEP documentation master file, created by sphinx-quickstart on Wed Sep 21 09:31:53 2022. You can adapt this file completely to your liking, but it should at least contain the root `toctree` directive. Ground State Calculation Setup ================================================ .. toctree:: :maxdepth: 1 :caption: Contents: pseudoatomic_solver.rst conduction.rst onetep_edft_documentation.rst AQUA-FOE.rst onetep_kernel_diis_documentation.rst VDW-correction.rst VDW-DF.rst realspace_local_pseudo.rst implicit_solvation_v3.rst hfx.rst cutoff_coulomb.rst scissor_operator.rst EMFT_in_ONETEP.rst