From 0ec9d399e6c61e88372628093308c315ebfd4fd9 Mon Sep 17 00:00:00 2001
From: Sam Waseda <o.waseda@mpie.de>
Date: Tue, 14 Mar 2023 09:18:30 +0100
Subject: [PATCH] Add symprec

---
 pyiron_contrib/atomistics/atomistics/master/qha.py | 2 ++
 1 file changed, 2 insertions(+)

diff --git a/pyiron_contrib/atomistics/atomistics/master/qha.py b/pyiron_contrib/atomistics/atomistics/master/qha.py
index ae5444b20..0b13e3cdf 100644
--- a/pyiron_contrib/atomistics/atomistics/master/qha.py
+++ b/pyiron_contrib/atomistics/atomistics/master/qha.py
@@ -270,6 +270,7 @@ def minimum_displacements(self):
                 structure=self.structure,
                 include_zero=self.include_zero_displacement,
                 second_order=self.second_order,
+                symprec=self._symprec
             ).displacements
             * self.dx
         )
@@ -401,6 +402,7 @@ def hessian(self):
                 self.structure,
                 include_zero_displacement=self.input["include_zero_displacement"],
                 second_order=self.input["second_order"],
+                symprec=self.input["symprec"],
             )
         return self._hessian