From 4a3dd43cdb8f1917381e0a36277435cc5aa6d9f2 Mon Sep 17 00:00:00 2001 From: Sarath Date: Thu, 11 Jul 2024 13:47:17 +0200 Subject: [PATCH] fix covera in hcp --- atomrdf/workflow/pyiron/pyiron.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/atomrdf/workflow/pyiron/pyiron.py b/atomrdf/workflow/pyiron/pyiron.py index a8ff767..99d0713 100644 --- a/atomrdf/workflow/pyiron/pyiron.py +++ b/atomrdf/workflow/pyiron/pyiron.py @@ -68,7 +68,7 @@ def bulk( repetitions=None, crystalstructure=None, a=None, - covera=None, + covera=1.633, cubic=True, graph=None, label=None,