From 979c619be725e1586144b3d53d843a7b7019998d Mon Sep 17 00:00:00 2001
From: Matthias Krack <matthias.krack@psi.ch>
Date: Fri, 22 Dec 2023 12:52:26 +0100
Subject: [PATCH] Example precision: let the SCF converge (#202)

---
 examples/single_calculations/example_precision.py | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/examples/single_calculations/example_precision.py b/examples/single_calculations/example_precision.py
index 0630595..d4e5d83 100644
--- a/examples/single_calculations/example_precision.py
+++ b/examples/single_calculations/example_precision.py
@@ -63,7 +63,7 @@ def example_precision(cp2k_code):
                     "BASIS_SET_FILE_NAME": "BASIS_MOLOPT",
                     "POTENTIAL_FILE_NAME": "GTH_POTENTIALS",
                     "SCF": {
-                        "MAX_SCF": 1,
+                        "MAX_SCF": 10,
                     },
                     "XC": {
                         "XC_FUNCTIONAL": {