Format using black 24.1.0

openkim · Jan 29, 2024 · 238ca81 · 238ca81
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commit 238ca81
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diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
@@ -21,7 +21,7 @@ repos:
         exclude: ^docs/
 
   - repo: https://github.com/psf/black
-    rev: 23.7.0
+    rev: 24.1.0
     hooks:
       - id: black
         exclude: ^docs/

diff --git a/examples/example_kim_SW_Si.py b/examples/example_kim_SW_Si.py
@@ -8,7 +8,6 @@
 on OpenKIM_.
 """
 
-
 ##########################################################################################
 # Before getting started to train the SW model, let's first make sure it is installed.
 #

diff --git a/examples/example_lennard_jones.py b/examples/example_lennard_jones.py
@@ -12,6 +12,7 @@
 
 .. _OpenKIM: https://openkim.org
 """
+
 from kliff.calculators import Calculator
 from kliff.dataset import Dataset
 from kliff.loss import Loss

diff --git a/examples/example_nn_Si.py b/examples/example_nn_Si.py
@@ -8,7 +8,6 @@
 
 """
 
-
 ##########################################################################################
 # We are going to fit the NN potential to a training set of energies and forces from
 # compressed and stretched diamond silicon structures (the same training set used in

diff --git a/examples/example_nn_SiC.py b/examples/example_nn_SiC.py
@@ -9,7 +9,6 @@
 specie (take a look at :ref:`tut_nn` for Si if you haven't yet).
 """
 
-
 from kliff import nn
 from kliff.calculators.calculator_torch import CalculatorTorchSeparateSpecies
 from kliff.dataset import Dataset

diff --git a/examples/example_parameter_transform.py b/examples/example_parameter_transform.py
@@ -18,7 +18,6 @@
 silicon that is archived on OpenKIM_. Compare this with :ref:`tut_kim_sw`.
 """
 
-
 ##########################################################################################
 # To start, let's first install the SW model::
 #

diff --git a/examples/example_uq_bootstrap.py b/examples/example_uq_bootstrap.py
@@ -14,7 +14,6 @@
 structure.
 """
 
-
 ##########################################################################################
 # To start, let's first install the SW model::
 #

diff --git a/examples/example_uq_mcmc.py b/examples/example_uq_mcmc.py
@@ -15,7 +15,6 @@
 consisting of 4 compressed and stretched configurations of diamond silicon structure.
 """
 
-
 ##########################################################################################
 # To start, let's first install the SW model::
 #

diff --git a/examples/legacy/eg_Fisher_info_kim_SW.py b/examples/legacy/eg_Fisher_info_kim_SW.py
@@ -5,7 +5,6 @@
 information theory based sensitivity analysis <https://doi.org/10.1063/1.5007842>`_
 """
 
-
 from kliff.analyzers import Fisher
 from kliff.calculators import Calculator
 from kliff.dataset import Dataset