From 1323ccbe65c97328d5788e834b3cf507f4e31571 Mon Sep 17 00:00:00 2001 From: Alexander Hampel Date: Tue, 4 Aug 2020 10:58:04 +0200 Subject: [PATCH] fix for rst file --- doc/reference/h5structure.rst | 1 + 1 file changed, 1 insertion(+) diff --git a/doc/reference/h5structure.rst b/doc/reference/h5structure.rst index e0e554b8..e38ec01d 100644 --- a/doc/reference/h5structure.rst +++ b/doc/reference/h5structure.rst @@ -113,6 +113,7 @@ dft_fermi_weights numpy.array.float, dim n_k x 1 x max(n_orbitals) (stored in dft_misc_input) of density matrix correction. band_window list of numpy.array.int , dim(SP+1-SO)x n_k x 2 Band windows as KS band indices in Vasp for each spin channel, and k-point. Needed for (stored in dft_misc_input) writing out the GAMMA file. +================= ====================================================================== =====================================================================================