From 8b5166f7ca8768ef44c81b186b51641fd8de34d2 Mon Sep 17 00:00:00 2001 From: nscolonna Date: Tue, 2 Jul 2024 08:35:22 +0200 Subject: [PATCH] Add basic documentation for kcw subblock --- docs/input_file.rst | 6 ++++++ 1 file changed, 6 insertions(+) diff --git a/docs/input_file.rst b/docs/input_file.rst index de6de019d..9d38543a5 100644 --- a/docs/input_file.rst +++ b/docs/input_file.rst @@ -158,6 +158,12 @@ The kcp subblock ~~~~~~~~~~~~~~~~ This subblock contains keywords specific to ``kcp.x``, a modified version of ``cp.x`` for performing Koopmans calculations. In addition to `the keywords associated with cp.x `_ there are several new keywords associated with the Koopmans implementation in ``kcp.x``. Non-experts will never need to change these. + +The kcw subblock +~~~~~~~~~~~~~~~ +This subblock contains keywords specific to ``kcw.x`` (see the `list of valid kcw.x keywords `_). Note that they should not be grouped by namelists as they are in a ``kcw.x`` input file. Non-experts will never need to change these keywords. + + The ui subblock ~~~~~~~~~~~~~~~ This subblock controls the unfolding and interpolation procedure for generating band structures and densities of states from Γ-only supercell calculations.