From 2e22d27013e87d08e9da8d1544f8b25718a97b01 Mon Sep 17 00:00:00 2001 From: "@jmmshn" Date: Thu, 22 Feb 2024 15:51:37 -0800 Subject: [PATCH] docs --- src/pyrho/charge_density.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/pyrho/charge_density.py b/src/pyrho/charge_density.py index a140be9..455b4dd 100644 --- a/src/pyrho/charge_density.py +++ b/src/pyrho/charge_density.py @@ -361,7 +361,7 @@ def get_matched_structure_mapping( temp = s2.copy().make_supercell(sc) ii, jj = 0, mapping[0] vec = np.round(sc_struct[ii].frac_coords - temp[jj].frac_coords) - return sc, vec + return sc, t + vec def get_volumetric_like_sc(