From 45a0fb9d776f354aa45e30f4b19677d7ae75e5b8 Mon Sep 17 00:00:00 2001 From: AndresOrtegaGuerrero Date: Tue, 3 Dec 2024 09:40:58 +0000 Subject: [PATCH] organize HTML --- src/aiidalab_qe/plugins/pdos/setting.py | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/src/aiidalab_qe/plugins/pdos/setting.py b/src/aiidalab_qe/plugins/pdos/setting.py index 3c5eb6039..462f3aa66 100644 --- a/src/aiidalab_qe/plugins/pdos/setting.py +++ b/src/aiidalab_qe/plugins/pdos/setting.py @@ -118,7 +118,8 @@ def render(self): However, if you need more control over the broadening, you can apply Gaussian broadening by specifying a custom degauss value.
- Recommendation for Molecules and Localized Orbitals:
+ Recommendation for Molecules and Localized Orbitals: +
For systems involving molecules or localized orbitals, it is recommended to use a custom degauss value. This will provide a more accurate representation of the PDOS, especially when the electronic states are localized.